Description Usage Format References Examples
Kazius et al (2005) investigated using chemical structure to predict mutagenicity (the increase of mutations due to the damage to genetic material). An Ames test was used to evaluate the mutagenicity potential of various chemicals. There were 4,337 compounds included in the data set with a mutagenicity rate of 55.3$%$. Using these compounds, the DragonX software (http://www.talete.mi.it/) was used to generate a baseline set of 1,579 predictors, including constitutional, topological and connectivity descriptors, among others. These variables consist of basic numeric variables (such as molecular weight) and counts variables (e.g., number of halogen atoms).
1 |
The descriptors are contained in a data frame called Mutagen_Dragon
and the outcomes are in a factor vector Mutagen_Outcomes
with levels "mutagen" and "nonmutagen"
Kazius et al. Derivation and validation of toxicophores for mutagenicity prediction. Journal of medicinal chemistry(Print) (2005) vol. 48 (1) pp. 312-320
1 2 |
MW AMW Sv Se Sp Ss Mv Me Mp Ms nAT nSK nBT nBO nBM
1 326.42 7.59 29.28 42.60 30.56 50.67 0.68 0.99 0.71 2.03 43 25 46 28 23
2 174.17 9.17 13.21 19.63 13.44 38.00 0.70 1.03 0.71 2.92 19 13 19 13 10
3 300.33 9.39 20.01 33.65 20.99 61.17 0.63 1.05 0.66 3.06 32 20 34 22 9
4 143.21 6.23 12.60 23.06 13.48 26.17 0.55 1.00 0.59 2.62 23 10 22 9 2
5 215.88 17.99 10.60 12.95 11.72 27.11 0.88 1.08 0.98 2.71 12 10 12 10 6
6 190.22 7.93 15.40 24.39 15.97 36.00 0.64 1.02 0.67 2.57 24 14 25 15 11
SCBO ARR nCIC nCIR RBN RBF nDB nTB nAB nH nC nN nO nP nS nF nCL nBR nI nX
1 39.5 0.821 4 4 4 0.087 0 0 23 18 22 2 1 0 0 0 0 0 0 0
2 20.0 0.462 1 1 2 0.105 4 0 6 6 9 2 2 0 0 0 0 0 0 0
3 28.5 0.227 3 4 3 0.088 4 0 5 12 10 4 5 0 1 0 0 0 0 0
4 11.0 0.000 0 0 5 0.227 2 0 0 13 7 1 2 0 0 0 0 0 0 0
5 13.0 0.600 1 1 0 0.000 0 0 6 2 6 0 0 0 0 0 4 0 0 4
6 21.0 0.667 2 3 3 0.120 1 0 10 10 10 2 2 0 0 0 0 0 0 0
nR03 nR04 nR05 nR06 nR07 nR08 nR09 nR10 nR11 nR12 nBnz ZM1 ZM1V ZM2
1 0 0 1 3 0 0 0 0 0 0 3 132 316.000 156
2 0 0 0 1 0 0 0 0 0 0 1 58 230.000 65
3 0 1 2 0 1 0 0 0 0 0 0 116 362.444 147
4 0 0 0 0 0 0 0 0 0 0 0 38 136.000 37
5 0 0 0 1 0 0 0 0 0 0 1 48 84.420 54
6 0 0 1 1 0 0 1 0 0 0 1 70 212.000 83
ZM2V Qindex SNar HNar GNar Xt Dz Ram Pol LPRS VDA MSD
1 352.000 19 19.474 2.113 2.179 0.227 52.000 7 38 118.979 119.440 0.231
2 206.000 6 8.148 1.733 1.872 0.350 29.000 3 17 47.339 39.077 0.293
3 279.667 21 13.523 1.739 1.966 0.272 47.000 10 36 84.503 69.800 0.209
4 102.000 2 4.970 1.500 1.644 0.449 22.500 2 8 33.542 29.200 0.391
5 92.444 7 5.781 1.579 1.783 0.416 21.333 4 13 30.850 22.200 0.285
6 207.000 10 9.940 1.909 2.034 0.317 31.000 4 20 51.707 41.143 0.262
SMTI SMTIV GMTI GMTIV Xu SPI W WA Har Har2 QW
1 6603 10336.000 6991 16775.00 23.977 6.729 1493 4.977 47.761 92.650 1104.000
2 1009 2332.000 879 4290.00 13.141 6.867 254 3.256 20.359 33.411 215.333
3 3012 6043.778 2980 11482.33 18.927 12.160 698 3.674 38.731 70.995 562.368
4 532 1026.000 413 1281.00 10.582 6.615 146 3.244 13.144 20.286 146.000
5 460 586.420 376 548.63 9.642 6.021 111 2.467 15.399 23.233 84.167
6 1231 2383.000 1156 4031.00 13.840 6.006 288 3.165 23.932 39.402 218.690
TI1 TI2 STN HyDp RHyDp w ww Rww D.D Wap WhetZ
1 108.673 2.788 6.985 5542 57.108 2669 15566 17.307 171.623 11750 1093.929
2 0.000 2.211 1.792 650 23.571 416 1517 12.405 51.707 649 167.286
3 46.556 2.286 4.554 1921 46.284 1399 6826 18.188 101.650 4695 512.663
4 -13.361 3.412 0.000 383 14.910 146 383 14.910 45.000 146 118.054
5 0.000 1.047 1.792 220 17.567 207 628 7.114 26.857 314 62.706
6 13.105 1.705 3.367 712 27.790 682 3174 8.608 42.349 1586 205.514
Whetm Whetv Whete Whetp J JhetZ Jhetm Jhetv Jhete Jhetp MAXDN
1 1093.998 1294.583 1095.152 1344.016 1.417 1.932 1.932 1.647 1.930 1.588 0.832
2 167.303 229.449 167.731 245.603 2.396 3.590 3.590 2.706 3.581 2.543 1.202
3 512.673 785.954 567.994 806.593 1.913 2.592 2.592 1.706 2.297 1.686 4.712
4 118.092 205.156 118.428 224.612 3.033 3.723 3.722 2.113 3.712 1.929 2.026
5 62.196 86.000 78.447 79.065 2.462 4.198 4.225 3.282 3.529 3.507 1.254
6 205.534 282.460 205.932 306.192 2.008 2.846 2.846 2.159 2.840 2.015 1.424
MAXDP DELS TIE S0K S1K S2K S3K PHI BLI PW2 PW3 PW4
1 1.886 10.395 26.782 104.096 15.523 6.857 3.157 4.258 0.879 0.567 0.338 0.188
2 2.996 13.799 18.054 38.106 9.091 4.133 1.975 2.890 0.818 0.534 0.326 0.186
3 5.544 49.438 58.554 84.439 13.525 4.025 1.602 2.722 1.016 0.621 0.386 0.212
4 3.434 9.816 16.970 31.219 9.338 5.149 6.338 4.808 1.035 0.535 0.246 0.083
5 1.500 11.998 13.649 15.219 8.460 3.175 1.924 2.686 1.177 0.600 0.347 0.142
6 3.489 12.663 18.300 53.303 9.064 3.700 1.489 2.396 0.880 0.549 0.348 0.216
PW5 PJI2 CSI ECC AECC DECC MDDD UNIP CENT VAR BAC Lop ICR D.Dr03
1 0.108 1.000 517 236 9.44 1.462 21.533 84 886 100 3 0.557 2.695 0
2 0.097 1.000 149 78 6.00 0.923 7.030 28 144 28 18 1.604 2.162 0
3 0.114 1.000 267 126 6.30 0.930 11.720 46 476 48 38 0.953 2.133 0
4 0.039 0.750 98 57 5.70 0.960 5.200 22 72 16 28 1.922 1.971 0
5 0.076 0.667 80 42 4.20 0.640 3.840 19 32 8 17 0.861 1.522 0
6 0.121 0.750 158 77 5.50 0.929 7.735 30 156 31 10 1.346 1.985 0
D.Dr04 D.Dr05 D.Dr06 D.Dr07 D.Dr08 D.Dr09 D.Dr10 D.Dr11 D.Dr12 T.N..N.
1 0.00 66.587 239.626 0.000 0 0.000 0 0 0 0
2 0.00 0.000 43.238 0.000 0 0.000 0 0 0 4
3 37.09 95.316 0.000 65.323 0 0.000 0 0 0 15
4 0.00 0.000 0.000 0.000 0 0.000 0 0 0 0
5 0.00 0.000 29.867 0.000 0 0.000 0 0 0 0
6 0.00 25.092 30.415 0.000 0 47.177 0 0 0 0
T.N..O. T.N..S. T.N..P. T.N..F. T.N..Cl. T.N..Br. T.N..I. T.O..O. T.O..S.
1 12 0 0 0 0 0 0 0 0
2 12 0 0 0 0 0 0 8 0
3 99 12 0 0 0 0 0 40 12
4 8 0 0 0 0 0 0 0 0
5 0 0 0 0 0 0 0 0 0
6 11 0 0 0 0 0 0 7 0
T.O..P. T.O..F. T.O..Cl. T.O..Br. T.O..I. T.S..S. T.S..P. T.S..F. T.S..Cl.
1 0 0 0 0 0 0 0 0 0
2 0 0 0 0 0 0 0 0 0
3 0 0 0 0 0 0 0 0 0
4 0 0 0 0 0 0 0 0 0
5 0 0 0 0 0 0 0 0 0
6 0 0 0 0 0 0 0 0 0
T.S..Br. T.P..P. T.P..Cl. T.P..Br. T.F..F. T.F..Cl. T.F..Br. T.Cl..Cl.
1 0 0 0 0 0 0 0 0
2 0 0 0 0 0 0 0 0
3 0 0 0 0 0 0 0 0
4 0 0 0 0 0 0 0 0
5 0 0 0 0 0 0 0 24
6 0 0 0 0 0 0 0 0
T.Cl..Br. T.Cl..I. T.Br..Br. T.I..I. MWC01 MWC02 MWC03 MWC04 MWC05 MWC06
1 0 0 0 0 28 4.890 5.746 6.619 7.497 8.383
2 0 0 0 0 13 4.078 4.875 5.700 6.526 7.362
3 0 0 0 0 22 4.762 5.687 6.663 7.625 8.606
4 0 0 0 0 9 3.664 4.317 5.043 5.720 6.450
5 0 0 0 0 10 3.892 4.691 5.533 6.358 7.195
6 0 0 0 0 15 4.263 5.118 5.999 6.884 7.778
MWC07 MWC08 MWC09 MWC10 TWC SRW01 SRW02 SRW03 SRW04 SRW05 SRW06 SRW07
1 9.272 10.166 11.061 11.959 128.595 25 56 0 208 10 944 112
2 8.196 9.035 9.871 10.711 92.355 13 26 0 90 0 386 0
3 9.582 10.566 11.548 12.535 119.575 20 44 0 196 20 1046 266
4 7.133 7.864 8.549 9.280 77.023 10 18 0 58 0 210 0
5 8.026 8.862 9.695 10.530 84.782 10 20 0 76 0 344 0
6 8.671 9.567 10.461 11.358 99.098 14 30 0 110 10 498 126
SRW08 SRW09 SRW10 MPC01 MPC02 MPC03 MPC04 MPC05 MPC06 MPC07 MPC08 MPC09 MPC10
1 4656 954 23996 28 38 52 69 90 101 118 132 152 156
2 1850 0 9366 13 16 20 23 24 18 14 10 4 1
3 6124 2700 37944 22 36 53 73 90 94 85 81 61 50
4 794 0 3068 9 10 8 6 5 5 2 0 0 0
5 1692 0 8660 10 14 16 16 18 10 2 0 0 0
6 2494 1134 13190 15 20 28 38 44 41 37 30 17 11
piPC01 piPC02 piPC03 piPC04 piPC05 piPC06 piPC07 piPC08 piPC09 piPC10 TPC
1 3.701 4.314 4.953 5.575 6.142 6.478 6.975 7.426 7.891 8.246 92.296
2 3.045 3.570 4.056 4.624 5.081 5.154 5.367 5.520 4.961 4.407 38.267
3 3.384 4.012 4.435 4.849 5.132 5.230 5.324 5.530 5.377 5.390 71.740
4 2.485 2.639 2.639 2.197 2.079 2.197 1.609 0.000 0.000 0.000 23.526
5 2.639 3.277 3.744 4.141 4.611 4.275 2.784 0.000 0.000 0.000 27.213
6 3.091 3.695 4.405 5.074 5.564 5.826 6.099 6.327 5.917 5.812 49.324
piID PCR PCD CID BID X0 X1 X2 X3 X4 X5
1 136.699 1.481 44.404 52.000 25.257 17.062 12.348 10.544 9.346 7.806 6.456
2 58.784 1.536 20.517 25.435 13.384 9.682 6.291 4.888 3.956 3.109 2.237
3 86.518 1.206 14.779 39.990 20.358 14.707 9.288 9.660 8.202 6.831 5.340
4 25.846 1.099 2.321 18.490 10.352 7.983 4.664 3.838 2.175 1.079 0.581
5 35.471 1.303 8.258 19.225 10.530 7.724 4.609 4.381 3.430 2.102 1.577
6 74.230 1.505 24.906 28.365 14.419 9.966 6.864 5.565 4.875 4.269 3.377
X0A X1A X2A X3A X4A X5A X0v X1v X2v X3v X4v X5v
1 0.682 0.441 0.277 0.180 0.113 0.072 13.938 8.202 5.770 4.177 2.877 1.973
2 0.745 0.484 0.305 0.198 0.135 0.093 6.943 3.547 2.327 1.609 0.952 0.520
3 0.735 0.422 0.268 0.155 0.094 0.059 11.317 7.450 7.726 6.756 5.195 3.704
4 0.798 0.518 0.384 0.272 0.180 0.116 6.462 3.105 2.175 0.949 0.388 0.178
5 0.772 0.461 0.313 0.214 0.131 0.088 7.690 3.922 3.309 2.408 1.265 0.849
6 0.712 0.458 0.278 0.174 0.112 0.077 7.551 4.400 3.071 2.244 1.619 1.035
X0Av X1Av X2Av X3Av X4Av X5Av X0sol X1sol X2sol X3sol X4sol X5sol
1 0.558 0.293 0.152 0.080 0.042 0.022 17.062 12.348 10.544 9.346 7.806 6.456
2 0.534 0.273 0.145 0.080 0.041 0.022 9.682 6.291 4.888 3.956 3.109 2.237
3 0.566 0.339 0.215 0.127 0.071 0.041 14.957 10.057 10.992 9.691 8.207 6.880
4 0.646 0.345 0.217 0.119 0.065 0.036 7.983 4.664 3.838 2.175 1.079 0.581
5 0.769 0.392 0.236 0.150 0.079 0.047 9.724 5.764 5.864 5.206 3.236 2.607
6 0.539 0.293 0.154 0.080 0.043 0.024 9.966 6.864 5.565 4.875 4.269 3.377
XMOD RDCHI RDSQ ISIZ IAC AAC IDE IDM IDDE IDDM IDET
1 76.018 3.754 213.292 233.329 58.163 1.353 3.347 8.009 3.524 4.610 1004.066
2 40.070 2.450 70.449 80.711 32.672 1.720 2.674 6.092 2.624 3.665 208.537
3 68.217 2.969 166.498 160.000 64.152 2.005 2.766 7.399 3.546 4.293 525.619
4 30.250 2.118 38.613 104.042 34.285 1.491 2.681 5.266 2.722 3.293 120.656
5 40.356 2.031 49.557 43.020 17.510 1.459 2.111 5.344 0.971 3.300 94.996
6 43.729 2.599 88.424 110.039 39.601 1.650 2.590 6.326 3.522 3.773 235.678
IDMT IVDE IVDM HVcpx HDcpx Uindex Vindex Xindex Yindex IC0 TIC0
1 11957.373 1.078 4.606 3.194 1.686 35.651 0.211 0.322 0.610 1.353 58.163
2 1547.345 1.457 3.613 2.636 1.488 24.698 0.479 0.700 1.442 1.720 32.672
3 5164.179 1.895 4.175 2.625 1.630 29.537 0.325 0.467 1.051 2.005 64.152
4 768.775 1.522 3.197 2.612 1.379 27.329 0.660 1.022 1.766 1.491 34.285
5 593.147 1.522 3.171 2.216 1.397 16.488 0.589 0.812 1.909 1.459 17.510
6 1821.773 1.379 3.740 2.539 1.516 21.125 0.395 0.566 1.246 1.650 39.601
SIC0 CIC0 BIC0 IC1 TIC1 SIC1 CIC1 BIC1 IC2 TIC2 SIC2 CIC2
1 0.249 4.074 0.231 2.726 117.214 0.502 2.700 0.466 3.308 142.252 0.610 2.118
2 0.405 2.528 0.366 3.076 58.446 0.724 1.172 0.654 3.221 61.201 0.758 1.027
3 0.401 2.995 0.375 3.921 125.471 0.784 1.079 0.734 4.664 149.245 0.933 0.336
4 0.330 3.033 0.325 2.786 64.068 0.616 1.738 0.608 3.501 80.532 0.774 1.022
5 0.407 2.126 0.373 1.918 23.020 0.535 1.667 0.491 1.918 23.020 0.535 1.667
6 0.360 2.935 0.333 3.435 82.429 0.749 1.150 0.693 4.002 96.039 0.873 0.583
BIC2 ATS1m ATS2m ATS3m ATS4m ATS5m ATS6m ATS7m ATS8m ATS1v ATS2v ATS3v ATS4v
1 0.566 3.412 3.714 3.722 3.672 3.655 3.623 3.526 3.245 3.289 3.574 3.555 3.492
2 0.685 2.730 2.932 2.979 2.835 2.590 2.051 1.299 1.021 2.468 2.674 2.721 2.478
3 0.873 3.531 3.914 3.905 3.997 3.886 3.230 2.638 1.357 2.888 3.270 3.283 3.192
4 0.764 2.442 2.560 2.356 2.100 1.905 1.921 1.099 0.000 2.031 2.139 1.930 1.654
5 0.491 2.934 3.421 3.808 3.409 2.914 0.000 0.000 0.000 2.398 2.708 2.639 1.946
6 0.808 2.867 3.123 3.135 3.020 2.677 2.184 1.413 0.000 2.620 2.909 2.874 2.641
ATS5v ATS6v ATS7v ATS8v ATS1e ATS2e ATS3e ATS4e ATS5e ATS6e ATS7e ATS8e ATS1p
1 3.528 3.529 3.447 3.179 3.411 3.713 3.720 3.670 3.653 3.622 3.526 3.245 3.274
2 2.010 1.318 0.705 0.233 2.727 2.930 2.976 2.832 2.587 2.046 1.296 1.016 2.434
3 2.933 2.548 1.945 0.625 3.283 3.730 3.794 3.794 3.807 3.225 2.633 1.352 2.928
4 1.619 1.551 1.099 0.000 2.439 2.558 2.353 2.097 1.902 1.919 1.099 0.000 1.979
5 1.099 0.000 0.000 0.000 2.490 2.840 2.852 2.226 1.436 0.000 0.000 0.000 2.481
6 2.117 1.482 0.573 0.000 2.864 3.121 3.133 3.017 2.674 2.180 1.408 0.000 2.594
ATS2p ATS3p ATS4p ATS5p ATS6p ATS7p ATS8p MATS1m MATS2m MATS3m MATS4m MATS5m
1 3.557 3.531 3.464 3.510 3.521 3.439 3.174 -0.094 0.007 -0.156 -0.171 -0.088
2 2.644 2.685 2.439 1.943 1.246 0.647 0.188 -0.128 0.314 -0.106 -0.200 -0.779
3 3.315 3.283 3.193 2.888 2.464 1.867 0.553 0.015 -0.212 -0.103 0.046 -0.040
4 2.104 1.894 1.607 1.591 1.512 1.099 0.000 -0.385 0.154 -0.095 -0.513 0.385
5 2.828 2.832 2.200 1.403 0.000 0.000 0.000 0.000 -0.286 -0.231 -0.167 1.500
6 2.883 2.840 2.595 2.055 1.411 0.507 0.000 0.239 0.131 -0.139 -0.367 -0.412
MATS6m MATS7m MATS8m MATS1v MATS2v MATS3v MATS4v MATS5v MATS6v MATS7v MATS8v
1 0.482 -0.020 -0.005 -0.101 0.029 -0.181 -0.208 -0.109 0.511 -0.016 0.009
2 0.164 -1.276 4.250 -0.159 0.335 -0.146 -0.170 -0.784 0.330 -1.238 3.715
3 0.026 0.000 -0.116 -0.113 0.063 -0.137 -0.472 0.396 0.006 -0.064 -0.173
4 -0.385 0.385 0.000 -0.431 0.125 -0.028 -0.527 0.445 -0.405 0.405 0.000
5 0.000 0.000 0.000 1.000 1.000 1.000 1.000 1.000 0.000 0.000 0.000
6 -0.505 1.690 0.000 0.292 0.127 -0.169 -0.394 -0.383 -0.412 1.421 0.000
MATS1e MATS2e MATS3e MATS4e MATS5e MATS6e MATS7e MATS8e MATS1p MATS2p MATS3p
1 -0.093 0.005 -0.153 -0.167 -0.086 0.478 -0.021 -0.006 -0.103 0.039 -0.191
2 -0.125 0.311 -0.101 -0.202 -0.777 0.145 -1.278 4.302 -0.173 0.339 -0.164
3 -0.027 0.037 -0.197 -0.409 0.450 -0.063 -0.161 -0.430 -0.207 0.104 -0.068
4 -0.380 0.156 -0.103 -0.511 0.378 -0.382 0.382 0.000 -0.451 0.111 0.004
5 0.000 -0.286 -0.231 -0.167 1.500 0.000 0.000 0.000 0.000 -0.286 -0.231
6 0.233 0.131 -0.136 -0.364 -0.415 -0.515 1.717 0.000 0.316 0.123 -0.182
MATS4p MATS5p MATS6p MATS7p MATS8p GATS1m GATS2m GATS3m GATS4m GATS5m GATS6m
1 -0.224 -0.118 0.515 -0.014 0.016 0.960 0.825 1.062 0.997 0.748 0.255
2 -0.151 -0.780 0.398 -1.208 3.444 0.767 0.311 0.684 1.067 2.157 1.657
3 -0.493 0.299 0.051 0.014 0.034 1.572 1.524 0.939 1.244 0.673 0.135
4 -0.531 0.469 -0.413 0.413 0.000 1.155 0.900 1.124 1.500 0.277 1.246
5 -0.167 1.500 0.000 0.000 0.000 0.750 1.071 1.154 1.250 0.000 0.000
6 -0.404 -0.368 -0.367 1.291 0.000 0.408 0.438 0.788 1.287 1.829 2.477
GATS7m GATS8m GATS1v GATS2v GATS3v GATS4v GATS5v GATS6v GATS7v GATS8v GATS1e
1 0.699 0.745 0.967 0.869 1.181 1.201 0.871 0.231 0.661 0.633 0.959
2 3.317 0.000 0.835 0.351 0.779 1.041 2.067 1.391 3.048 0.000 0.760
3 0.168 0.247 0.904 0.816 1.053 1.462 0.756 0.850 1.020 1.383 0.721
4 0.000 0.000 1.226 0.897 1.038 1.494 0.281 1.264 0.000 0.000 1.148
5 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.750
6 1.749 0.000 0.411 0.496 0.857 1.312 1.727 2.213 1.604 0.000 0.409
GATS2e GATS3e GATS4e GATS5e GATS6e GATS7e GATS8e GATS1p GATS2p GATS3p GATS4p
1 0.821 1.049 0.976 0.734 0.260 0.703 0.757 0.970 0.888 1.235 1.293
2 0.309 0.675 1.069 2.164 1.686 3.341 0.000 0.868 0.378 0.825 1.024
3 0.791 1.129 1.394 0.766 0.949 1.182 1.748 1.280 0.932 0.926 1.582
4 0.900 1.133 1.500 0.278 1.244 0.000 0.000 1.262 0.893 0.995 1.488
5 1.071 1.154 1.250 0.000 0.000 0.000 0.000 0.750 1.071 1.154 1.250
6 0.433 0.781 1.284 1.839 2.503 1.762 0.000 0.415 0.528 0.890 1.321
GATS5p GATS6p GATS7p GATS8p EPS0 EPS1 EEig01x EEig02x EEig03x EEig04x
1 0.927 0.227 0.642 0.582 17.577 13.807 4.565 4.122 3.909 3.729
2 2.014 1.273 2.900 0.000 8.845 6.326 4.366 3.587 3.137 2.864
3 0.706 0.557 0.655 0.848 12.664 10.810 5.207 4.064 3.995 3.794
4 0.293 1.271 0.000 0.000 6.268 4.360 3.699 3.210 2.309 2.000
5 0.000 0.000 0.000 0.000 6.138 4.869 4.324 3.637 3.000 1.781
6 1.675 2.083 1.525 0.000 9.793 7.319 4.639 3.543 3.357 2.741
EEig05x EEig06x EEig07x EEig08x EEig09x EEig10x EEig11x EEig12x EEig13x
1 3.384 2.967 2.854 2.500 2.500 2.500 2.443 2.250 1.643
2 2.838 1.611 1.358 0.958 0.704 -0.089 -0.347 -0.488 -0.500
3 3.230 2.583 2.524 2.118 1.931 1.000 0.989 0.725 0.550
4 0.885 0.129 0.000 -0.369 -0.864 0.000 0.000 0.000 0.000
5 0.874 0.500 -0.137 -0.198 -0.281 -0.500 0.000 0.000 0.000
6 2.568 2.186 1.935 0.832 0.696 0.500 0.038 -0.360 -0.461
EEig14x EEig15x EEig01d EEig02d EEig03d EEig04d EEig05d EEig06d EEig07d
1 0.842 0.827 3.203 2.875 2.595 2.511 1.945 1.524 1.480
2 0.000 0.000 3.252 3.036 2.829 2.116 1.529 1.112 0.609
3 0.365 -0.087 5.578 3.848 3.772 3.266 2.568 2.330 1.341
4 0.000 0.000 3.564 2.589 1.774 0.788 0.376 -0.387 -0.600
5 0.000 0.000 3.461 3.035 2.318 1.904 0.275 0.242 -0.475
6 -0.500 -0.714 3.272 2.598 2.206 1.680 1.528 1.188 0.903
EEig08d EEig09d EEig10d EEig11d EEig12d EEig13d EEig14d EEig15d EEig01r
1 1.095 1.000 1.000 1.000 0.872 0.759 -0.218 -0.544 4.170
2 0.114 -0.510 -1.135 -1.320 -1.551 -2.000 0.000 0.000 3.957
3 1.022 0.772 0.618 0.566 0.204 -0.082 -0.446 -0.540 4.884
4 -1.283 -1.500 0.000 0.000 0.000 0.000 0.000 0.000 3.331
5 -1.176 -1.344 -2.000 0.000 0.000 0.000 0.000 0.000 3.804
6 -0.011 -0.680 -0.835 -1.075 -1.558 -1.787 -1.888 -2.000 4.165
EEig02r EEig03r EEig04r EEig05r EEig06r EEig07r EEig08r EEig09r EEig10r
1 3.733 3.506 3.310 2.904 2.515 2.363 2.000 2.000 2.000
2 3.072 2.414 2.281 2.047 1.236 0.774 0.292 0.018 -0.414
3 3.829 3.609 3.407 2.842 2.138 2.098 1.686 1.604 0.829
4 3.097 2.000 1.314 0.626 -0.100 -0.247 -0.523 -0.998 0.000
5 3.108 2.481 1.220 0.349 -0.081 -0.708 -0.753 -0.820 -1.000
6 3.156 2.913 2.282 2.146 1.814 1.269 0.523 0.195 0.086
EEig11r EEig12r EEig13r EEig14r EEig15r ESpm02u ESpm03u ESpm04u ESpm05u
1 1.946 1.693 1.344 0.453 0.436 4.344 3.761 5.911 6.236
2 -0.766 -0.911 -1.000 0.000 0.000 3.497 2.944 5.004 5.352
3 0.501 0.107 0.000 -0.015 -0.367 4.290 4.443 6.232 7.179
4 0.000 0.000 0.000 0.000 0.000 3.045 2.565 4.344 4.511
5 0.000 0.000 0.000 0.000 0.000 3.367 3.219 4.949 5.485
6 -0.317 -0.783 -0.890 -0.960 -1.000 3.714 3.219 5.303 5.740
ESpm06u ESpm07u ESpm08u ESpm09u ESpm10u ESpm11u ESpm12u ESpm13u ESpm14u
1 7.783 8.531 9.829 10.784 11.981 13.036 14.197 15.301 16.451
2 6.845 7.609 8.865 9.814 10.972 12.001 13.119 14.183 15.285
3 8.615 9.844 11.214 12.541 13.908 15.269 16.643 18.017 19.395
4 5.844 6.304 7.430 8.042 9.057 9.757 10.709 11.462 12.377
5 6.808 7.637 8.808 9.767 10.879 11.898 12.986 14.034 15.114
6 7.251 8.112 9.399 10.441 11.646 12.760 13.935 15.077 16.242
ESpm15u ESpm01x ESpm02x ESpm03x ESpm04x ESpm05x ESpm06x ESpm07x ESpm08x
1 17.581 3.701 4.896 6.095 7.386 8.719 10.087 11.480 12.894
2 16.364 3.045 4.182 5.372 6.647 7.965 9.316 10.692 12.088
3 20.775 3.384 4.730 6.018 7.441 8.907 10.414 11.952 13.513
4 13.165 2.485 3.584 4.654 5.829 7.032 8.262 9.508 10.766
5 16.176 2.639 3.839 5.095 6.425 7.788 9.171 10.569 11.980
6 17.395 3.091 4.270 5.475 6.787 8.154 9.565 11.007 12.473
ESpm09x ESpm10x ESpm11x ESpm12x ESpm13x ESpm14x ESpm15x ESpm01d ESpm02d
1 14.323 15.765 17.216 18.676 20.143 21.617 23.095 1.001 4.363
2 13.500 14.926 16.361 17.805 19.255 20.710 22.169 2.206 3.848
3 15.093 16.689 18.296 19.913 21.537 23.167 24.802 2.742 4.647
4 12.033 13.306 14.585 15.868 17.154 18.443 19.735 1.844 3.358
5 13.399 14.827 16.260 17.699 19.142 20.589 22.038 1.980 3.657
6 13.958 15.455 16.962 18.476 19.995 21.518 23.044 1.513 3.833
ESpm03d ESpm04d ESpm05d ESpm06d ESpm07d ESpm08d ESpm09d ESpm10d ESpm11d
1 4.000 5.971 6.409 7.884 8.687 9.954 10.931 12.113 13.174
2 4.443 5.754 6.696 7.889 8.952 10.109 11.218 12.365 13.495
3 5.796 7.392 8.923 10.546 12.188 13.857 15.541 17.237 18.940
4 4.159 5.418 6.550 7.783 9.002 10.247 11.494 12.750 14.010
5 4.352 5.678 6.695 7.928 9.062 10.276 11.459 12.672 13.876
6 3.885 5.512 6.186 7.521 8.483 9.706 10.793 11.980 13.120
ESpm12d ESpm13d ESpm14d ESpm15d ESpm01r ESpm02r ESpm03r ESpm04r ESpm05r
1 14.324 15.427 16.569 17.693 3.339 4.640 5.673 6.899 8.140
2 14.642 15.783 16.932 18.080 2.639 3.831 4.841 6.037 7.262
3 20.649 22.360 24.074 25.790 3.091 4.536 5.725 7.103 8.510
4 15.273 16.537 17.804 19.072 2.251 3.372 4.344 5.465 6.595
5 15.094 16.309 17.531 18.754 2.152 3.573 4.614 5.846 7.075
6 14.298 15.461 16.639 17.812 2.747 4.012 5.052 6.288 7.553
ESpm06r ESpm07r ESpm08r ESpm09r ESpm10r ESpm11r ESpm12r ESpm13r ESpm14r
1 9.429 10.741 12.073 13.419 14.777 16.144 17.519 18.901 20.288
2 8.537 9.838 11.160 12.496 13.843 15.197 16.557 17.920 19.287
3 9.964 11.447 12.953 14.477 16.016 17.565 19.123 20.688 22.257
4 7.750 8.912 10.082 11.255 12.432 13.610 14.791 15.972 17.156
5 8.336 9.610 10.897 12.193 13.497 14.808 16.123 17.442 18.765
6 8.869 10.213 11.580 12.963 14.358 15.762 17.171 18.585 20.003
ESpm15r BEHm1 BEHm2 BEHm3 BEHm4 BEHm5 BEHm6 BEHm7 BEHm8 BELm1 BELm2 BELm3
1 21.681 4.035 3.779 3.725 3.514 2.991 2.679 2.654 2.617 1.991 1.947 1.910
2 20.655 3.877 3.319 3.113 2.854 2.490 2.067 1.370 1.161 1.954 1.411 1.181
3 23.831 4.673 3.786 3.557 3.309 2.929 2.460 2.227 2.164 1.819 1.755 1.487
4 18.340 3.545 3.346 2.871 2.500 2.331 1.833 1.094 0.967 1.759 1.616 1.405
5 20.090 4.130 3.650 3.403 3.239 2.529 2.238 1.523 0.578 1.775 0.969 0.513
6 21.422 4.076 3.341 3.193 2.812 2.589 2.226 2.040 1.456 1.978 1.720 1.370
BELm4 BELm5 BELm6 BELm7 BELm8 BEHv1 BEHv2 BEHv3 BEHv4 BEHv5 BEHv6 BEHv7 BEHv8
1 1.448 1.388 1.250 1.082 1.082 3.975 3.772 3.737 3.429 2.888 2.669 2.647 2.647
2 1.019 0.726 0.497 0.189 0.000 3.840 3.072 2.944 2.798 2.394 2.045 1.031 0.901
3 1.237 1.221 0.803 0.706 0.642 3.955 3.553 3.235 3.037 2.703 2.439 2.025 1.862
4 1.249 0.832 0.656 0.227 0.000 3.413 3.268 2.815 2.414 2.338 1.772 1.116 0.487
5 0.058 0.000 0.000 0.000 0.000 3.791 2.782 2.698 1.559 1.297 1.207 0.439 0.382
6 1.088 0.972 0.746 0.395 0.384 4.020 3.324 3.023 2.720 2.296 2.195 1.851 1.250
BELv1 BELv2 BELv3 BELv4 BELv5 BELv6 BELv7 BELv8 BEHe1 BEHe2 BEHe3 BEHe4 BEHe5
1 1.980 1.954 1.879 1.533 1.401 1.296 0.996 0.996 4.063 3.830 3.788 3.570 3.121
2 1.966 1.405 1.315 1.237 0.755 0.520 0.022 0.000 3.911 3.321 3.141 3.030 2.572
3 1.985 1.891 1.586 1.413 1.325 1.196 0.828 0.707 4.113 3.801 3.417 3.330 2.995
4 1.797 1.630 1.346 1.117 0.914 0.596 0.164 0.000 3.633 3.458 3.066 2.700 2.662
5 1.839 0.939 0.784 0.000 0.000 0.000 0.000 0.000 3.832 2.852 2.799 1.766 1.615
6 1.976 1.763 1.476 1.120 0.901 0.732 0.667 0.332 4.103 3.443 3.285 2.904 2.672
BEHe6 BEHe7 BEHe8 BELe1 BELe2 BELe3 BELe4 BELe5 BELe6 BELe7 BELe8 BEHp1 BEHp2
1 2.797 2.769 2.769 1.905 1.863 1.798 1.305 1.225 0.993 0.799 0.799 3.970 3.776
2 2.280 1.520 1.392 1.877 1.143 1.093 0.925 0.508 0.252 0.000 0.000 3.839 3.048
3 2.704 2.400 2.285 1.800 1.694 1.350 1.084 0.976 0.845 0.440 0.255 4.085 3.536
4 2.158 1.594 1.226 1.536 1.413 1.049 0.761 0.528 0.156 0.000 0.000 3.413 3.270
5 1.507 0.768 0.636 1.788 0.776 0.726 0.000 0.000 0.000 0.000 0.000 3.813 2.844
6 2.404 2.255 1.776 1.899 1.568 1.175 0.899 0.675 0.286 0.165 0.000 4.017 3.331
BEHp3 BEHp4 BEHp5 BEHp6 BEHp7 BEHp8 BELp1 BELp2 BELp3 BELp4 BELp5 BELp6 BELp7
1 3.742 3.421 2.892 2.676 2.660 2.660 1.976 1.950 1.868 1.542 1.396 1.286 0.966
2 2.949 2.787 2.394 2.061 1.027 0.958 1.966 1.435 1.286 1.253 0.739 0.502 0.000
3 3.254 3.122 2.751 2.457 2.024 1.870 1.905 1.891 1.575 1.437 1.311 1.113 0.801
4 2.828 2.447 2.339 1.800 1.160 0.496 1.793 1.623 1.318 1.068 0.903 0.553 0.105
5 2.732 1.744 1.434 1.389 0.616 0.507 1.819 0.904 0.732 0.000 0.000 0.000 0.000
6 3.018 2.726 2.274 2.197 1.855 1.255 1.976 1.768 1.478 1.114 0.877 0.744 0.639
BELp8 GGI1 GGI2 GGI3 GGI4 GGI5 GGI6 GGI7 GGI8 GGI9 GGI10 JGI1 JGI2
1 0.966 3.5 2.444 1.097 1.234 1.029 0.271 0.152 0.227 0.125 0.05 0.125 0.064
2 0.000 2.0 1.556 0.938 0.653 0.236 0.121 0.031 0.000 0.000 0.00 0.154 0.097
3 0.681 6.0 4.111 3.799 2.478 0.816 0.412 0.144 0.031 0.000 0.00 0.273 0.121
4 0.000 2.5 0.889 0.375 0.160 0.222 0.082 0.000 0.000 0.000 0.00 0.278 0.089
5 0.000 3.0 1.778 0.750 0.604 0.000 0.000 0.000 0.000 0.000 0.00 0.300 0.127
6 0.277 2.0 1.556 1.389 0.507 0.316 0.141 0.028 0.000 0.000 0.00 0.133 0.078
JGI3 JGI4 JGI5 JGI6 JGI7 JGI8 JGI9 JGI10 JGT LP1 Eig1Z Eig1m
1 0.029 0.034 0.029 0.008 0.005 0.009 0.008 0.005 0.316 2.472 91.153 91.160
2 0.055 0.047 0.024 0.024 0.016 0.000 0.000 0.000 0.416 2.314 26.598 26.601
3 0.106 0.071 0.026 0.022 0.014 0.016 0.000 0.000 0.647 2.692 53.555 53.558
4 0.047 0.027 0.044 0.016 0.000 0.000 0.000 0.000 0.501 2.031 24.462 24.469
5 0.058 0.101 0.000 0.000 0.000 0.000 0.000 0.000 0.585 2.303 13.021 12.915
6 0.069 0.030 0.029 0.024 0.014 0.000 0.000 0.000 0.377 2.450 31.012 31.015
Eig1v Eig1e Eig1p SEigZ SEigm SEigv SEige SEigp AEigZ AEigm
1 109.596 91.254 114.148 0.536 0.535 -1.832 0.522 -2.400 181.770 181.784
2 36.897 26.671 39.603 0.786 0.784 -2.786 0.769 -3.600 52.411 52.418
3 81.621 58.415 84.843 2.446 2.443 -6.445 1.856 -8.008 105.804 105.813
4 41.854 24.539 45.780 0.643 0.641 -2.347 0.631 -3.000 48.281 48.297
5 18.000 16.369 16.502 2.588 2.645 0.000 0.839 0.771 23.455 23.185
6 43.600 31.073 47.711 0.786 0.784 -2.786 0.769 -3.600 61.238 61.246
AEigv AEige AEigp VEA1 VEA2 VRA1 VRA2 VED1 VED2 VRD1 VRD2
1 221.024 181.985 230.696 4.223 0.169 27.419 1.097 4.908 0.196 27.493 1.100
2 76.581 52.572 82.806 3.190 0.245 12.471 0.959 3.540 0.272 12.586 0.968
3 169.729 114.974 179.564 3.687 0.184 21.375 1.069 4.403 0.220 21.531 1.077
4 86.054 48.446 94.561 2.973 0.297 8.538 0.854 3.115 0.312 8.632 0.863
5 36.000 31.899 32.233 2.987 0.299 9.474 0.947 3.121 0.312 9.603 0.960
6 89.985 61.377 99.022 3.313 0.237 14.437 1.031 3.673 0.262 14.551 1.039
VEZ1 VEZ2 VRZ1 VRZ2 VEm1 VEm2 VRm1 VRm2 VEv1 VEv2 VRv1 VRv2
1 4.910 0.196 27.492 1.100 4.910 0.196 27.492 1.100 4.880 0.195 27.503 1.100
2 3.556 0.274 12.582 0.968 3.556 0.274 12.582 0.968 3.532 0.272 12.589 0.968
3 4.392 0.220 21.518 1.076 4.392 0.220 21.518 1.076 4.391 0.220 21.528 1.076
4 3.118 0.312 8.625 0.863 3.118 0.312 8.625 0.863 3.127 0.313 8.622 0.862
5 3.136 0.314 9.588 0.959 3.137 0.314 9.587 0.959 3.098 0.310 9.623 0.962
6 3.661 0.262 14.552 1.039 3.661 0.262 14.552 1.039 3.622 0.259 14.573 1.041
VEe1 VEe2 VRe1 VRe2 VEp1 VEp2 VRp1 VRp2 DP01 DP02 DP03 DP04
1 4.910 0.196 27.492 1.100 4.874 0.195 27.505 1.100 4.861 6.076 7.042 7.819
2 3.556 0.274 12.582 0.968 3.527 0.271 12.590 0.968 3.790 4.579 5.135 5.529
3 4.419 0.221 21.517 1.076 4.368 0.218 21.529 1.076 4.332 5.176 5.746 6.125
4 3.118 0.312 8.625 0.863 3.127 0.313 8.622 0.862 3.487 4.248 4.760 5.082
5 3.109 0.311 9.614 0.961 3.108 0.311 9.615 0.962 3.361 3.940 4.253 4.381
6 3.661 0.262 14.552 1.039 3.610 0.258 14.577 1.041 3.861 4.613 5.093 5.373
DP05 DP06 DP07 DP08 DP09 DP10 DP11 DP12 DP13 DP14 DP15 DP16 DP17
1 8.441 8.930 9.301 9.567 9.737 9.821 9.824 9.753 9.612 9.407 9.140 8.816 8.437
2 5.795 5.949 6.001 5.960 5.830 5.618 5.328 4.966 4.536 4.044 3.496 2.902 2.279
3 6.355 6.459 6.454 6.352 6.162 5.891 5.546 5.132 4.654 4.117 3.528 2.897 2.242
4 5.245 5.271 5.177 4.978 4.683 4.302 3.846 3.322 2.745 2.133 1.521 0.965 0.530
5 4.363 4.220 3.967 3.616 3.179 2.669 2.106 1.525 0.981 0.543 0.257 0.106 0.040
6 5.491 5.473 5.335 5.092 4.753 4.330 3.829 3.262 2.642 1.993 1.360 0.810 0.411
DP18 DP19 DP20 SP01 SP02 SP03 SP04 SP05 SP06 SP07 SP08 SP09
1 8.006 7.526 6.999 4.633 5.942 6.983 7.821 8.492 9.022 9.428 9.723 9.919
2 1.655 1.080 0.616 3.638 4.539 5.181 5.639 5.951 6.138 6.214 6.188 6.070
3 1.595 1.011 0.556 3.927 4.876 5.537 5.995 6.294 6.461 6.512 6.460 6.315
4 0.251 0.105 0.040 3.311 4.111 4.657 5.013 5.209 5.267 5.203 5.029 4.757
5 0.014 0.004 0.001 3.030 3.779 4.229 4.470 4.545 4.477 4.283 3.977 3.571
6 0.179 0.070 0.025 3.663 4.548 5.129 5.481 5.650 5.669 5.559 5.336 5.014
SP10 SP11 SP12 SP13 SP14 SP15 SP16 SP17 SP18 SP19 SP20 SHP2
1 10.024 10.046 9.991 9.864 9.670 9.414 9.098 8.726 8.302 7.827 7.304 0.330
2 5.865 5.580 5.220 4.791 4.299 3.749 3.151 2.516 1.872 1.260 0.745 0.454
3 6.085 5.776 5.393 4.942 4.428 3.857 3.238 2.583 1.918 1.286 0.755 0.406
4 4.397 3.957 3.447 2.879 2.270 1.652 1.076 0.609 0.296 0.126 0.049 0.514
5 3.078 2.515 1.909 1.307 0.778 0.393 0.170 0.065 0.023 0.007 0.002 0.630
6 4.602 4.109 3.546 2.924 2.264 1.601 0.998 0.530 0.240 0.095 0.034 0.455
W3D J3D H3D AGDD DDI ADDD G1 G2 RGyr SPAN SPAM
1 5475.781 1.760 210.937 254.687 907.816 42.224 35.114 16.498 4.268 8.109 0.434
2 635.289 2.926 58.209 66.873 180.627 19.013 15.570 8.506 2.831 4.504 0.487
3 2061.015 2.394 148.136 128.813 505.667 31.604 37.409 16.874 2.942 5.604 0.418
4 1028.665 5.781 82.755 89.449 245.757 21.370 11.233 6.263 2.683 5.008 0.467
5 206.803 2.313 25.248 34.467 80.998 13.500 17.026 7.195 2.662 3.120 0.510
6 1112.555 2.407 87.587 92.713 288.331 24.028 17.984 9.495 2.799 5.105 0.461
MEcc SPH ASP FDI PJI3 L.Bw SEig HOMA RCI AROM HOMT DISPm
1 1.000 0.939 0.492 0.987 0.903 3.94 93.493 0.734 1.397 0.962 19.082 1.540
2 1.000 0.968 0.582 1.000 0.922 5.02 39.111 0.508 1.474 0.919 4.066 1.083
3 0.994 0.642 0.274 0.995 0.784 2.55 67.685 0.907 1.354 0.933 4.535 2.802
4 0.998 0.719 0.609 0.936 0.905 9.43 44.539 0.012 0.000 0.000 0.037 8.775
5 1.000 1.000 0.397 1.000 0.561 2.59 27.088 0.995 1.385 0.998 5.970 0.008
6 1.000 0.869 0.261 1.000 0.641 1.58 49.304 0.745 1.470 0.936 8.936 8.895
QXXm QYYm QZZm DISPv QXXv QYYv QZZv DISPe QXXe QYYe
1 105.597 396.013 489.542 5.345 133.260 449.112 563.851 0.165 222.337 753.353
2 19.435 97.025 116.193 1.438 27.159 61.439 87.652 0.029 53.982 107.286
3 73.865 159.926 200.223 1.856 57.483 138.010 162.318 0.140 125.990 243.485
4 13.260 80.968 84.053 7.616 19.665 101.277 103.588 0.208 46.395 194.409
5 35.518 91.891 127.409 0.004 19.130 34.927 54.057 0.000 29.554 42.676
6 55.404 74.963 125.815 10.015 43.222 77.793 113.153 0.339 87.867 150.940
QZZe DISPp QXXp QYYp QZZp G.N..N. G.N..O. G.N..S. G.N..P. G.N..F.
1 937.746 0.398 144.196 480.659 603.870 0.000 12.952 0.000 0 0
2 158.285 0.105 30.350 59.362 88.506 4.722 13.910 0.000 0 0
3 293.046 0.235 62.372 141.676 167.528 16.844 94.190 11.918 0 0
4 200.422 0.457 22.686 111.415 113.896 0.000 7.659 0.000 0 0
5 72.230 0.000 22.451 41.891 64.342 0.000 0.000 0.000 0 0
6 220.201 0.689 44.442 83.777 119.035 0.000 12.722 0.000 0 0
G.N..Cl. G.N..Br. G.N..I. G.O..O. G.O..S. G.O..P. G.O..F. G.O..Cl. G.O..Br.
1 0 0 0 0.000 0.00 0 0 0 0
2 0 0 0 8.965 0.00 0 0 0 0
3 0 0 0 40.895 14.03 0 0 0 0
4 0 0 0 0.000 0.00 0 0 0 0
5 0 0 0 0.000 0.00 0 0 0 0
6 0 0 0 7.137 0.00 0 0 0 0
G.O..I. G.S..S. G.S..P. G.S..F. G.S..Cl. G.S..Br. G.P..P. G.P..Cl. G.P..Br.
1 0 0 0 0 0 0 0 0 0
2 0 0 0 0 0 0 0 0 0
3 0 0 0 0 0 0 0 0 0
4 0 0 0 0 0 0 0 0 0
5 0 0 0 0 0 0 0 0 0
6 0 0 0 0 0 0 0 0 0
G.F..F. G.F..Cl. G.F..Br. G.Cl..Cl. G.Cl..Br. G.Cl..I. G.Br..Br. G.I..I.
1 0 0 0 0.000 0 0 0 0
2 0 0 0 0.000 0 0 0 0
3 0 0 0 0.000 0 0 0 0
4 0 0 0 0.000 0 0 0 0
5 0 0 0 29.525 0 0 0 0
6 0 0 0 0.000 0 0 0 0
RDF010u RDF015u RDF020u RDF025u RDF030u RDF035u RDF040u RDF045u RDF050u
1 9.081 9.824 6.410 30.182 9.940 13.495 15.616 19.871 19.810
2 2.822 4.173 1.142 13.280 0.466 9.898 7.589 4.227 2.692
3 5.589 9.858 4.418 21.121 18.321 16.408 21.744 14.770 13.235
4 5.727 5.510 5.298 14.896 6.479 5.659 7.170 6.109 8.560
5 0.971 1.566 0.521 2.173 0.899 0.971 8.214 3.996 1.115
6 4.900 5.788 3.531 11.691 5.067 10.707 3.452 11.066 6.871
RDF055u RDF060u RDF065u RDF070u RDF075u RDF080u RDF085u RDF090u RDF095u
1 9.974 15.180 18.150 15.200 12.518 11.563 8.265 14.431 5.51
2 1.854 4.722 0.113 1.875 0.000 1.478 0.000 0.885 0.00
3 15.014 7.711 11.950 3.901 6.994 0.986 1.631 0.116 0.00
4 3.879 7.082 2.770 5.884 2.506 3.556 2.405 0.035 0.00
5 0.773 0.007 0.002 0.000 0.000 0.000 0.000 0.000 0.00
6 4.901 2.566 6.906 2.717 2.139 0.589 0.586 0.000 0.00
RDF100u RDF105u RDF110u RDF115u RDF120u RDF125u RDF130u RDF135u RDF140u
1 14.581 11.463 7.655 5.189 4.934 5.037 2.275 2.342 0.035
2 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000
3 0.015 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000
4 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000
5 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000
6 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000
RDF145u RDF150u RDF155u RDF010m RDF015m RDF020m RDF025m RDF030m RDF035m
1 0.001 0 0 0.777 9.733 0.708 19.711 5.482 2.867
2 0.000 0 0 0.275 4.188 0.103 11.106 0.366 4.253
3 0.000 0 0 0.525 13.134 2.909 16.617 7.712 11.370
4 0.000 0 0 0.494 6.255 0.481 5.973 1.390 0.763
5 0.000 0 0 0.082 1.595 0.055 2.384 4.153 0.082
6 0.000 0 0 0.449 6.077 0.414 6.755 0.831 5.824
RDF040m RDF045m RDF050m RDF055m RDF060m RDF065m RDF070m RDF075m RDF080m
1 2.950 7.556 6.285 5.249 6.772 8.812 7.077 2.041 5.962
2 3.364 0.927 0.478 0.126 0.498 0.013 2.771 0.000 1.969
3 10.762 13.930 4.860 7.327 3.557 6.627 0.451 4.062 0.192
4 1.006 0.730 1.868 1.167 0.999 0.338 0.257 0.399 0.164
5 23.585 11.796 0.113 6.735 0.058 0.019 0.000 0.000 0.000
6 1.937 4.912 2.734 1.506 1.368 0.378 2.547 0.190 0.066
RDF085m RDF090m RDF095m RDF100m RDF105m RDF110m RDF115m RDF120m RDF125m
1 2.502 3.839 2.667 5.390 1.783 2.234 2.117 1.076 1.213
2 0.000 1.570 0.000 0.000 0.000 0.000 0.000 0.000 0.000
3 0.199 0.109 0.000 0.002 0.000 0.000 0.000 0.000 0.000
4 0.046 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000
5 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000
6 0.004 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000
RDF130m RDF135m RDF140m RDF145m RDF150m RDF155m RDF010v RDF015v RDF020v
1 0.19 0.06 0 0 0 0 2.628 8.928 1.633
2 0.00 0.00 0 0 0 0 0.851 4.142 0.343
3 0.00 0.00 0 0 0 0 1.549 8.400 2.084
4 0.00 0.00 0 0 0 0 1.714 4.237 1.138
5 0.00 0.00 0 0 0 0 0.290 1.566 0.158
6 0.00 0.00 0 0 0 0 1.338 5.324 0.909
RDF025v RDF030v RDF035v RDF040v RDF045v RDF050v RDF055v RDF060v RDF065v
1 18.817 5.040 4.985 5.105 8.315 7.496 6.019 7.675 7.887
2 8.930 0.340 4.611 4.222 1.439 0.709 0.353 0.910 0.017
3 11.651 5.873 7.138 7.759 6.529 3.974 4.483 2.882 5.391
4 5.421 1.315 1.069 1.938 1.436 2.468 1.501 1.802 0.588
5 2.173 0.604 0.290 8.052 3.996 0.191 0.773 0.007 0.002
6 6.178 1.228 4.928 1.364 5.055 2.231 1.819 1.164 1.171
RDF070v RDF075v RDF080v RDF085v RDF090v RDF095v RDF100v RDF105v RDF110v
1 8.501 3.928 6.843 3.423 4.213 2.833 6.302 2.885 3.338
2 0.814 0.000 0.756 0.000 0.232 0.000 0.000 0.000 0.000
3 0.860 2.889 0.260 0.357 0.050 0.000 0.002 0.000 0.000
4 1.097 0.740 0.695 0.293 0.003 0.000 0.000 0.000 0.000
5 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000
6 1.047 0.528 0.090 0.052 0.000 0.000 0.000 0.000 0.000
RDF115v RDF120v RDF125v RDF130v RDF135v RDF140v RDF145v RDF150v RDF155v
1 1.558 1.483 1.768 0.676 0.329 0.003 0 0 0
2 0.000 0.000 0.000 0.000 0.000 0.000 0 0 0
3 0.000 0.000 0.000 0.000 0.000 0.000 0 0 0
4 0.000 0.000 0.000 0.000 0.000 0.000 0 0 0
5 0.000 0.000 0.000 0.000 0.000 0.000 0 0 0
6 0.000 0.000 0.000 0.000 0.000 0.000 0 0 0
RDF010e RDF015e RDF020e RDF025e RDF030e RDF035e RDF040e RDF045e RDF050e
1 8.695 10.098 6.643 29.954 10.033 12.963 15.248 19.831 19.210
2 2.668 4.189 1.074 14.140 0.484 10.057 7.403 4.287 2.541
3 5.542 10.837 4.839 23.414 20.860 18.021 23.928 17.674 13.727
4 5.398 6.238 5.598 15.095 6.112 5.453 7.234 6.239 8.396
5 0.915 1.570 0.492 2.202 1.259 0.914 10.320 5.057 1.122
6 4.889 6.073 3.683 11.704 4.929 10.990 3.854 11.373 6.857
RDF055e RDF060e RDF065e RDF070e RDF075e RDF080e RDF085e RDF090e RDF095e
1 9.741 14.709 18.759 14.939 12.113 11.296 8.026 14.032 5.423
2 1.707 4.996 0.141 2.759 0.000 1.962 0.000 1.559 0.000
3 16.898 8.187 12.774 3.785 7.722 0.909 1.800 0.140 0.000
4 3.963 6.544 2.607 5.378 2.321 3.253 2.154 0.031 0.000
5 1.238 0.011 0.004 0.000 0.000 0.000 0.000 0.000 0.000
6 5.053 2.925 6.750 3.397 2.177 0.736 0.520 0.000 0.000
RDF100e RDF105e RDF110e RDF115e RDF120e RDF125e RDF130e RDF135e RDF140e
1 14.471 10.907 7.475 5.314 4.565 5.083 2.142 2.108 0.031
2 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000
3 0.019 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000
4 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000
5 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000
6 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000
RDF145e RDF150e RDF155e RDF010p RDF015p RDF020p RDF025p RDF030p RDF035p
1 0 0 0 3.322 8.874 2.014 19.203 5.197 5.908
2 0 0 0 1.077 4.135 0.435 8.945 0.341 5.004
3 0 0 0 1.949 8.387 2.149 12.105 6.802 7.914
4 0 0 0 2.181 3.996 1.376 5.854 1.582 1.357
5 0 0 0 0.370 1.569 0.202 2.199 0.924 0.370
6 0 0 0 1.684 5.251 1.123 6.340 1.465 5.146
RDF040p RDF045p RDF050p RDF055p RDF060p RDF065p RDF070p RDF075p RDF080p
1 5.992 8.970 8.269 6.410 8.232 8.394 9.124 4.707 7.213
2 4.570 1.655 0.839 0.473 1.124 0.020 0.697 0.000 0.672
3 9.317 6.660 4.498 4.948 3.004 5.517 1.084 2.951 0.303
4 2.383 1.754 2.937 1.654 2.221 0.738 1.493 0.895 0.940
5 9.976 4.950 0.304 1.186 0.010 0.003 0.000 0.000 0.000
6 1.408 5.416 2.391 2.020 1.200 1.559 1.023 0.649 0.102
RDF085p RDF090p RDF095p RDF100p RDF105p RDF110p RDF115p RDF120p RDF125p
1 3.826 4.932 3.04 6.944 3.603 3.772 1.735 1.716 2.009
2 0.000 0.183 0.00 0.000 0.000 0.000 0.000 0.000 0.000
3 0.430 0.048 0.00 0.003 0.000 0.000 0.000 0.000 0.000
4 0.437 0.005 0.00 0.000 0.000 0.000 0.000 0.000 0.000
5 0.000 0.000 0.00 0.000 0.000 0.000 0.000 0.000 0.000
6 0.085 0.000 0.00 0.000 0.000 0.000 0.000 0.000 0.000
RDF130p RDF135p RDF140p RDF145p RDF150p RDF155p Mor01u Mor02u Mor03u Mor04u
1 0.862 0.474 0.005 0 0 0 903 34.441 -2.144 1.309
2 0.000 0.000 0.000 0 0 0 171 13.687 -1.832 0.207
3 0.000 0.000 0.000 0 0 0 496 18.086 -2.625 -0.095
4 0.000 0.000 0.000 0 0 0 253 27.408 -3.244 0.815
5 0.000 0.000 0.000 0 0 0 66 9.174 -1.465 0.125
6 0.000 0.000 0.000 0 0 0 276 19.355 -2.448 -0.363
Mor05u Mor06u Mor07u Mor08u Mor09u Mor10u Mor11u Mor12u Mor13u Mor14u Mor15u
1 -6.431 -3.794 5.808 1.175 -1.343 -0.313 1.145 -0.943 -0.017 0.462 0.977
2 -2.903 -1.523 2.106 0.192 0.085 -0.966 -0.096 0.553 0.301 0.015 0.114
3 -5.150 0.197 1.707 2.432 -0.636 -0.393 -0.468 -0.940 0.676 0.503 -0.031
4 -2.796 -2.184 0.870 0.925 1.143 -1.201 -0.831 -0.636 0.268 1.065 -0.010
5 -1.750 0.907 0.113 0.196 -0.083 -0.443 0.382 -0.338 0.266 -0.222 0.128
6 -2.883 -2.428 4.050 0.428 -0.674 0.423 0.457 -0.836 0.330 -0.012 0.146
Mor16u Mor17u Mor18u Mor19u Mor20u Mor21u Mor22u Mor23u Mor24u Mor25u Mor26u
1 1.182 -1.051 -2.043 0.977 2.973 -1.571 0.520 -1.507 -0.423 1.573 0.307
2 -0.046 0.179 -0.647 0.364 0.484 -0.413 0.178 -0.350 0.015 0.196 -0.102
3 -0.162 -0.573 -1.355 1.409 0.094 -0.409 0.133 -0.318 -0.489 0.613 0.019
4 -0.079 -0.878 -0.511 0.604 1.309 -0.688 -0.232 0.083 -0.412 0.508 0.354
5 0.079 0.065 -0.400 -0.246 0.739 -0.260 0.025 -0.279 -0.099 0.393 -0.098
6 0.518 -0.677 -0.656 0.379 0.956 -0.305 -0.190 -0.587 -0.089 0.544 -0.050
Mor27u Mor28u Mor29u Mor30u Mor31u Mor32u Mor01m Mor02m Mor03m Mor04m Mor05m
1 -0.545 -0.137 0.078 -0.250 0.771 -0.415 356.037 21.295 -2.780 -1.435 -4.861
2 0.091 -0.094 -0.151 0.040 0.118 0.172 97.497 10.827 -0.609 -0.530 -2.779
3 0.277 -0.010 -0.577 0.409 0.444 -0.076 296.896 15.276 -1.703 -1.998 -3.457
4 -0.072 -0.360 -0.412 0.169 0.349 0.370 65.092 9.701 -1.159 -0.442 -1.568
5 -0.157 0.083 -0.136 0.065 0.152 -0.224 141.118 7.328 -3.704 -0.208 -3.076
6 -0.275 0.016 -0.296 0.107 0.382 -0.160 117.257 12.001 -0.968 -1.515 -2.242
Mor06m Mor07m Mor08m Mor09m Mor10m Mor11m Mor12m Mor13m Mor14m Mor15m Mor16m
1 1.468 4.758 -1.432 -2.768 1.248 0.971 1.373 -1.127 -1.129 1.302 0.666
2 -0.078 2.195 -0.488 -0.327 -0.586 0.216 1.055 -0.194 -0.412 0.105 -0.294
3 1.459 2.914 0.267 -1.526 -1.133 1.608 0.072 -0.313 -0.165 0.184 0.182
4 0.325 1.312 -0.522 -0.479 0.209 -0.066 0.227 -0.387 -0.080 0.455 -0.208
5 4.189 -1.108 -0.229 0.257 -1.493 0.619 -0.460 0.436 -0.211 -0.239 0.131
6 -0.402 2.815 -0.804 -1.230 0.374 0.663 0.434 -0.393 -0.608 0.403 0.329
Mor17m Mor18m Mor19m Mor20m Mor21m Mor22m Mor23m Mor24m Mor25m Mor26m Mor27m
1 0.341 -1.329 -0.115 1.650 -0.446 -0.074 -0.754 0.102 0.825 -0.178 -0.427
2 0.359 -0.287 -0.016 0.201 -0.248 0.221 -0.048 0.212 -0.083 -0.181 0.068
3 -0.342 -0.615 0.652 -0.092 -0.506 0.252 0.004 -0.229 0.111 -0.010 0.107
4 -0.063 -0.047 0.103 0.247 -0.223 -0.002 0.139 -0.041 0.087 -0.187 0.152
5 -0.105 -0.484 -0.888 1.364 -0.608 0.065 -0.380 -0.273 0.372 -0.674 0.114
6 -0.186 -0.228 -0.161 0.422 -0.135 -0.104 -0.163 0.087 0.211 -0.164 -0.102
Mor28m Mor29m Mor30m Mor31m Mor32m Mor01v Mor02v Mor03v Mor04v Mor05v Mor06v
1 0.026 0.331 0.243 0.060 -0.667 416.294 22.816 -2.155 -0.926 -4.699 0.065
2 0.003 -0.027 0.018 -0.120 0.168 81.697 9.464 -0.618 -0.227 -2.180 -0.092
3 0.208 -0.028 0.196 -0.185 0.151 192.523 12.178 -1.310 -0.827 -2.330 0.574
4 0.098 -0.130 0.069 -0.015 0.116 74.849 9.897 -0.704 -0.120 -1.517 -0.344
5 0.236 -0.362 0.083 -0.131 -0.262 51.067 7.835 -1.383 -0.081 -1.777 1.389
6 0.086 -0.015 0.127 -0.066 -0.213 112.425 11.442 -1.197 -1.166 -1.789 -0.578
Mor07v Mor08v Mor09v Mor10v Mor11v Mor12v Mor13v Mor14v Mor15v Mor16v Mor17v
1 4.417 -0.749 -2.147 0.574 0.925 0.587 -0.729 -0.670 1.148 0.649 -0.060
2 1.574 -0.289 -0.279 -0.356 0.189 0.486 -0.220 -0.101 0.187 -0.089 0.138
3 1.410 0.369 -0.483 -0.231 0.403 -0.350 -0.089 0.327 0.114 -0.150 -0.160
4 0.882 -0.021 0.045 -0.177 -0.129 -0.186 -0.128 0.283 0.267 -0.189 -0.247
5 0.182 -0.208 -0.100 -0.418 0.450 -0.064 0.034 -0.334 0.182 0.113 0.093
6 2.546 -0.453 -0.914 0.292 0.526 -0.035 -0.216 -0.350 0.446 0.245 -0.309
Mor18v Mor19v Mor20v Mor21v Mor22v Mor23v Mor24v Mor25v Mor26v Mor27v Mor28v
1 -1.323 0.103 1.824 -0.657 0.023 -0.832 -0.001 0.958 -0.035 -0.451 0.059
2 -0.371 0.142 0.209 -0.167 0.071 -0.137 0.109 0.042 -0.070 0.056 -0.045
3 -0.478 0.600 -0.064 -0.335 0.182 -0.127 -0.204 0.084 0.102 0.131 0.001
4 -0.080 0.137 0.435 -0.236 -0.045 0.063 -0.169 0.216 0.023 0.044 -0.034
5 -0.321 -0.345 0.702 -0.219 -0.029 -0.191 -0.073 0.370 -0.208 -0.093 0.062
6 -0.290 0.025 0.524 -0.108 -0.121 -0.334 0.061 0.257 -0.036 -0.161 0.006
Mor29v Mor30v Mor31v Mor32v Mor01e Mor02e Mor03e Mor04e Mor05e Mor06e Mor07e
1 0.233 0.113 0.254 -0.565 886.158 34.511 -2.339 1.085 -6.479 -3.473 5.908
2 -0.046 0.023 -0.032 0.122 182.310 14.049 -1.946 0.311 -3.175 -1.516 2.328
3 -0.197 0.162 0.180 0.046 548.316 17.867 -2.855 -0.195 -5.724 0.409 2.305
4 -0.206 0.097 0.124 0.135 254.136 27.575 -3.617 1.010 -2.913 -2.102 1.166
5 -0.058 0.087 0.048 -0.224 76.704 9.097 -1.794 0.262 -1.982 1.313 -0.144
6 -0.035 0.107 0.099 -0.200 284.957 20.007 -2.369 -0.434 -3.194 -2.465 4.153
Mor08e Mor09e Mor10e Mor11e Mor12e Mor13e Mor14e Mor15e Mor16e Mor17e Mor18e
1 1.096 -1.607 -0.135 1.299 -0.773 -0.134 0.376 1.018 1.203 -0.939 -2.045
2 0.124 0.019 -1.077 -0.029 0.731 0.324 -0.114 0.099 -0.117 0.277 -0.593
3 2.554 -1.106 -0.503 -0.248 -0.800 0.614 0.445 -0.092 -0.124 -0.571 -1.360
4 0.844 0.930 -1.157 -0.628 -0.701 0.229 0.994 -0.009 -0.067 -0.802 -0.503
5 0.230 -0.018 -0.560 0.405 -0.385 0.335 -0.234 0.088 0.064 0.091 -0.423
6 0.421 -0.825 0.422 0.585 -0.753 0.279 -0.089 0.108 0.574 -0.618 -0.647
Mor19e Mor20e Mor21e Mor22e Mor23e Mor24e Mor25e Mor26e Mor27e Mor28e Mor29e
1 0.867 2.925 -1.469 0.434 -1.466 -0.416 1.513 0.302 -0.556 -0.145 0.109
2 0.300 0.487 -0.445 0.253 -0.327 0.056 0.148 -0.156 0.087 -0.076 -0.134
3 1.395 0.037 -0.428 0.207 -0.275 -0.577 0.673 -0.054 0.313 0.094 -0.561
4 0.581 1.270 -0.677 -0.224 0.124 -0.414 0.514 0.301 -0.084 -0.307 -0.367
5 -0.305 0.801 -0.297 0.039 -0.290 -0.121 0.398 -0.148 -0.129 0.105 -0.182
6 0.295 0.927 -0.323 -0.179 -0.506 -0.101 0.527 -0.111 -0.264 0.059 -0.274
Mor30e Mor31e Mor32e Mor01p Mor02p Mor03p Mor04p Mor05p Mor06p Mor07p Mor08p
1 -0.221 0.722 -0.456 454.070 23.867 -1.996 -0.770 -4.749 -0.418 4.475 -0.518
2 0.029 0.094 0.193 84.828 9.563 -0.655 -0.160 -2.132 -0.224 1.535 -0.226
3 0.407 0.380 -0.072 211.736 12.945 -1.579 -0.636 -2.575 0.701 1.026 0.682
4 0.147 0.301 0.396 86.053 11.024 -0.710 -0.016 -1.657 -0.557 0.832 0.117
5 0.081 0.138 -0.225 62.417 8.082 -1.626 -0.001 -1.953 1.641 -0.018 -0.133
6 0.108 0.316 -0.171 121.135 11.910 -1.237 -1.121 -1.796 -0.752 2.608 -0.330
Mor09p Mor10p Mor11p Mor12p Mor13p Mor14p Mor15p Mor16p Mor17p Mor18p Mor19p
1 -2.013 0.414 0.924 0.360 -0.613 -0.536 1.117 0.679 -0.192 -1.362 0.189
2 -0.228 -0.373 0.166 0.402 -0.189 -0.033 0.181 -0.061 0.099 -0.404 0.184
3 -0.342 -0.311 0.310 -0.420 -0.014 0.294 0.182 -0.130 -0.241 -0.575 0.738
4 0.190 -0.296 -0.198 -0.271 -0.056 0.379 0.232 -0.186 -0.327 -0.104 0.171
5 -0.034 -0.534 0.474 -0.157 0.125 -0.316 0.132 0.109 0.094 -0.351 -0.385
6 -0.860 0.279 0.506 -0.154 -0.140 -0.289 0.429 0.239 -0.355 -0.319 0.083
Mor20p Mor21p Mor22p Mor23p Mor24p Mor25p Mor26p Mor27p Mor28p Mor29p Mor30p
1 1.927 -0.749 0.065 -0.895 -0.041 1.024 0.010 -0.466 0.055 0.205 0.066
2 0.232 -0.172 0.055 -0.165 0.091 0.077 -0.062 0.054 -0.056 -0.057 0.026
3 -0.047 -0.354 0.175 -0.186 -0.194 0.115 0.142 0.091 -0.025 -0.202 0.192
4 0.507 -0.254 -0.068 0.039 -0.193 0.256 0.069 0.027 -0.076 -0.236 0.111
5 0.776 -0.266 -0.010 -0.215 -0.096 0.386 -0.243 -0.075 0.082 -0.105 0.089
6 0.565 -0.126 -0.124 -0.377 0.049 0.287 -0.020 -0.176 -0.003 -0.060 0.102
Mor31p Mor32p L1u L2u L3u P1u P2u G1u G2u G3u E1u E2u
1 0.330 -0.545 17.285 4.880 0.462 0.764 0.216 0.168 0.201 0.258 0.522 0.433
2 -0.011 0.122 4.815 2.863 0.083 0.620 0.369 0.684 0.191 1.000 0.367 0.468
3 0.165 0.044 6.116 2.549 1.173 0.622 0.259 0.184 0.176 0.235 0.430 0.364
4 0.157 0.151 7.731 1.163 0.919 0.788 0.119 0.207 0.181 0.233 0.512 0.512
5 0.056 -0.226 2.911 2.306 0.000 0.558 0.442 1.000 1.000 1.000 0.460 0.601
6 0.146 -0.195 5.833 3.024 0.406 0.630 0.326 0.179 0.240 0.204 0.511 0.368
E3u L1m L2m L3m P1m P2m G1m G2m G3m E1m E2m E3m
1 0.304 14.368 3.649 0.217 0.788 0.200 0.156 0.156 0.221 0.364 0.246 0.067
2 0.105 6.681 1.331 0.009 0.833 0.166 0.684 0.191 1.000 0.706 0.101 0.001
3 0.466 5.774 2.262 0.643 0.665 0.261 0.184 0.167 0.167 0.384 0.286 0.126
4 0.359 6.377 0.677 0.421 0.853 0.091 0.181 0.181 0.181 0.353 0.169 0.076
5 0.211 5.112 1.976 0.000 0.721 0.279 1.000 1.000 1.000 1.418 0.441 0.629
6 0.319 4.865 3.081 0.141 0.602 0.381 0.204 0.179 0.192 0.409 0.349 0.038
L1v L2v L3v P1v P2v G1v G2v G3v E1v E2v E3v L1e
1 15.025 4.233 0.314 0.768 0.216 0.168 0.156 0.214 0.396 0.329 0.141 17.239
2 4.616 2.021 0.036 0.692 0.303 0.684 0.191 1.000 0.337 0.233 0.019 5.391
3 6.068 2.044 0.828 0.679 0.229 0.167 0.184 0.167 0.423 0.233 0.229 6.103
4 7.347 0.874 0.686 0.825 0.098 0.181 0.207 0.181 0.462 0.285 0.199 7.556
5 3.296 1.805 0.000 0.646 0.354 1.000 1.000 1.000 0.589 0.368 0.283 3.297
6 4.799 2.549 0.254 0.631 0.335 0.179 0.204 0.228 0.348 0.261 0.124 5.818
L2e L3e P1e P2e G1e G2e G3e E1e E2e E3e L1p L2p
1 4.774 0.445 0.768 0.213 0.156 0.168 0.227 0.520 0.415 0.283 15.389 4.375
2 2.675 0.076 0.662 0.329 0.684 0.191 1.000 0.460 0.409 0.088 4.371 2.213
3 2.606 1.134 0.620 0.265 0.184 0.184 0.167 0.427 0.381 0.427 5.880 2.102
4 1.136 0.876 0.790 0.119 0.181 0.181 0.181 0.490 0.490 0.327 7.515 0.934
5 2.283 0.000 0.591 0.409 1.000 1.000 1.000 0.590 0.588 0.290 3.576 1.916
6 3.210 0.381 0.618 0.341 0.179 0.179 0.216 0.508 0.413 0.281 4.971 2.485
L3p P1p P2p G1p G2p G3p E1p E2p E3p L1s L2s L3s
1 0.342 0.765 0.218 0.168 0.156 0.227 0.415 0.351 0.168 13.992 3.542 0.184
2 0.045 0.659 0.334 0.684 0.191 1.000 0.302 0.280 0.030 8.105 1.098 0.000
3 0.870 0.664 0.237 0.184 0.176 0.184 0.398 0.246 0.255 6.493 2.618 0.733
4 0.748 0.817 0.102 0.195 0.207 0.233 0.483 0.325 0.237 6.586 0.646 0.313
5 0.000 0.651 0.349 1.000 1.000 1.000 0.694 0.415 0.349 4.228 1.747 0.000
6 0.287 0.642 0.321 0.179 0.179 0.204 0.376 0.247 0.159 5.353 3.338 0.093
P1s P2s G1s G2s G3s E1s E2s E3s Tu Tm Tv Te
1 0.790 0.200 0.201 0.177 0.212 0.346 0.232 0.048 22.626 18.234 19.572 22.458
2 0.881 0.119 1.000 0.213 1.000 1.040 0.069 0.000 7.761 8.021 6.673 8.141
3 0.660 0.266 0.188 0.188 0.188 0.501 0.380 0.156 9.838 8.678 8.939 9.843
4 0.873 0.086 0.231 0.231 0.231 0.381 0.144 0.042 9.814 7.476 8.907 9.568
5 0.708 0.292 1.000 1.000 1.000 0.970 0.344 0.481 5.217 7.088 5.101 5.579
6 0.609 0.380 0.208 0.208 0.235 0.590 0.358 0.016 9.263 8.087 7.602 9.409
Tp Ts Au Am Av Ae Ap As Gu Gm Gs
1 20.105 17.719 94.583 56.336 69.652 92.098 74.081 52.793 0.206 0.175 0.196
2 6.629 9.203 14.426 8.966 9.566 15.031 9.967 8.901 0.507 0.507 0.597
3 8.852 9.844 25.758 18.222 19.115 25.781 19.301 23.679 0.197 0.172 0.188
4 9.197 7.545 17.168 7.288 12.060 16.194 13.338 6.521 0.206 0.181 0.231
5 5.492 5.975 6.713 10.101 5.949 7.526 6.852 7.385 1.000 1.000 1.000
6 7.743 8.783 21.235 16.113 14.099 22.116 14.494 18.672 0.206 0.191 0.217
Ku Km Kv Ke Kp Ks Du Dm Dv De Dp Ds
1 0.646 0.682 0.652 0.651 0.648 0.685 0.420 0.225 0.289 0.406 0.311 0.208
2 0.484 0.749 0.538 0.493 0.490 0.821 0.313 0.270 0.197 0.319 0.204 0.370
3 0.432 0.498 0.518 0.430 0.496 0.489 0.420 0.265 0.295 0.412 0.300 0.346
4 0.682 0.780 0.737 0.685 0.726 0.809 0.461 0.199 0.316 0.436 0.348 0.189
5 0.500 0.582 0.500 0.500 0.500 0.562 0.424 0.829 0.413 0.489 0.486 0.599
6 0.445 0.474 0.450 0.439 0.463 0.484 0.399 0.265 0.244 0.401 0.261 0.321
Vu Vm Vv Ve Vp Vs ITH ISH HIC HGM H0u
1 156.140 85.944 109.209 151.205 117.211 79.637 104.587 0.901 5.038 4.593 3
2 23.337 17.069 16.573 24.268 17.030 18.104 38.106 0.792 3.588 9.493 3
3 53.891 35.291 38.320 53.660 38.901 45.987 72.439 0.838 4.792 7.376 3
4 35.248 16.583 25.372 33.277 27.783 15.400 28.464 0.857 4.319 10.783 3
5 11.930 17.190 11.050 13.105 12.344 13.360 15.219 0.458 3.266 12.888 2
6 37.657 26.318 24.813 38.645 25.783 29.113 49.303 0.925 4.311 9.742 3
H1u H2u H3u H4u H5u H6u H7u H8u HTu HATS0u HATS1u HATS2u
1 2.321 2.842 2.513 1.173 0.906 0.627 0.588 0.583 27.420 0.313 0.203 0.312
2 1.361 1.105 0.632 0.541 0.376 0.086 0.000 0.000 11.203 1.048 0.253 0.691
3 2.073 2.282 1.697 1.408 1.120 0.744 0.105 0.044 21.946 0.353 0.213 0.323
4 1.814 2.069 1.089 0.826 0.242 0.062 0.084 0.147 15.710 0.490 0.249 0.455
5 0.960 0.774 0.799 0.000 0.000 0.000 0.000 0.000 7.064 0.473 0.123 0.226
6 1.951 2.069 1.597 0.564 0.246 0.053 0.032 0.000 16.025 0.509 0.258 0.413
HATS3u HATS4u HATS5u HATS6u HATS7u HATS8u HATSu H0m H1m H2m H3m
1 0.392 0.293 0.206 0.190 0.360 0.560 9 1.189 1.113 0.932 0.598
2 0.190 0.542 1.064 1.074 0.111 0.050 9 1.583 0.953 0.551 0.330
3 0.461 0.676 0.798 0.917 0.498 0.333 9 2.213 1.531 1.212 0.578
4 0.515 0.918 0.544 0.320 0.415 0.424 9 0.860 0.482 0.236 0.198
5 0.652 0.538 0.225 0.000 0.000 0.000 4 10.721 1.761 1.575 2.246
6 0.658 0.569 0.650 0.810 0.579 0.262 9 1.550 1.071 0.684 0.344
H4m H5m H6m H7m H8m HTm HATS0m HATS1m HATS2m HATS3m HATS4m
1 0.295 0.161 0.107 0.068 0.036 7.840 0.080 0.081 0.083 0.059 0.030
2 0.234 0.086 0.010 0.000 0.000 5.912 0.254 0.126 0.083 0.078 0.150
3 0.395 0.431 0.184 0.009 0.000 10.895 0.205 0.135 0.183 0.175 0.279
4 0.049 0.008 0.000 0.008 0.001 2.826 0.083 0.051 0.066 0.077 0.055
5 0.000 0.000 0.000 0.000 0.000 21.886 3.095 0.230 0.475 2.064 1.808
6 0.103 0.011 0.003 0.003 0.000 5.992 0.216 0.136 0.108 0.115 0.152
HATS5m HATS6m HATS7m HATS8m HATSm H0v H1v H2v H3v H4v H5v H6v
1 0.037 0.073 0.108 0.103 1.698 1.238 1.307 1.245 0.812 0.403 0.249 0.183
2 0.205 0.181 0.083 0.089 2.244 0.931 0.694 0.391 0.248 0.175 0.085 0.013
3 0.416 0.237 0.173 0.060 3.527 1.046 0.989 0.818 0.487 0.334 0.239 0.141
4 0.039 0.065 0.055 0.020 0.946 0.830 0.710 0.426 0.230 0.108 0.027 0.006
5 1.536 0.000 0.000 0.000 15.321 1.599 0.787 0.600 0.408 0.000 0.000 0.000
6 0.191 0.172 0.107 0.013 2.205 0.952 0.874 0.694 0.369 0.116 0.029 0.008
H7v H8v HTv HATS0v HATS1v HATS2v HATS3v HATS4v HATS5v HATS6v HATS7v
1 0.159 0.113 10.350 0.094 0.104 0.124 0.109 0.068 0.055 0.093 0.157
2 0.000 0.000 4.142 0.165 0.104 0.100 0.079 0.188 0.274 0.181 0.038
3 0.015 0.004 7.101 0.094 0.094 0.114 0.141 0.191 0.223 0.204 0.131
4 0.018 0.013 3.908 0.097 0.091 0.100 0.133 0.138 0.088 0.080 0.100
5 0.000 0.000 5.189 0.384 0.101 0.190 0.433 0.333 0.181 0.000 0.000
6 0.005 0.000 5.142 0.108 0.103 0.125 0.147 0.161 0.187 0.171 0.098
HATS8v HATSv H0e H1e H2e H3e H4e H5e H6e H7e H8e HTe
1 0.181 2.720 2.840 2.282 2.800 2.399 1.150 0.864 0.591 0.546 0.536 26.358
2 0.013 2.120 3.184 1.475 1.174 0.656 0.596 0.445 0.107 0.000 0.000 12.090
3 0.067 2.445 3.359 2.267 2.448 1.877 1.552 1.309 0.813 0.122 0.039 24.213
4 0.085 1.801 2.851 1.762 1.959 1.064 0.857 0.233 0.055 0.095 0.130 15.200
5 0.000 2.860 2.664 1.085 0.899 1.051 0.000 0.000 0.000 0.000 0.000 8.735
6 0.034 2.168 3.150 2.111 2.126 1.574 0.596 0.250 0.056 0.039 0.000 16.654
HATS0e HATS1e HATS2e HATS3e HATS4e HATS5e HATS6e HATS7e HATS8e HATSe H0p
1 0.289 0.198 0.303 0.366 0.273 0.191 0.182 0.342 0.523 8.487 1.337
2 1.029 0.266 0.641 0.189 0.561 1.041 1.246 0.144 0.089 9.383 0.994
3 0.389 0.234 0.353 0.508 0.748 0.935 0.981 0.535 0.350 9.876 1.128
4 0.452 0.239 0.429 0.496 0.859 0.511 0.304 0.425 0.389 8.493 0.946
5 0.674 0.139 0.263 0.846 0.710 0.325 0.000 0.000 0.000 5.242 2.258
6 0.535 0.287 0.419 0.640 0.566 0.678 0.861 0.624 0.266 9.299 1.014
H1p H2p H3p H4p H5p H6p H7p H8p HTp HATS0p HATS1p HATS2p
1 1.410 1.393 0.940 0.463 0.297 0.219 0.199 0.150 11.733 0.107 0.115 0.142
2 0.708 0.425 0.258 0.187 0.095 0.015 0.000 0.000 4.369 0.208 0.113 0.134
3 1.061 0.903 0.564 0.376 0.267 0.166 0.018 0.006 7.849 0.102 0.101 0.127
4 0.823 0.539 0.284 0.143 0.039 0.009 0.022 0.021 4.713 0.120 0.108 0.123
5 0.932 0.746 0.634 0.000 0.000 0.000 0.000 0.000 6.882 0.578 0.120 0.230
6 0.927 0.778 0.437 0.137 0.040 0.010 0.005 0.000 5.684 0.122 0.110 0.145
HATS3p HATS4p HATS5p HATS6p HATS7p HATS8p HATSp RCON RARS REIG R1u
1 0.133 0.086 0.066 0.102 0.178 0.215 3.234 23.578 0.552 0.666 2.106
2 0.085 0.210 0.332 0.209 0.036 0.010 2.464 11.437 0.695 0.882 1.476
3 0.163 0.213 0.247 0.233 0.145 0.080 2.748 22.694 0.745 0.788 1.938
4 0.164 0.189 0.117 0.096 0.121 0.115 2.304 16.876 0.822 0.877 1.849
5 0.613 0.491 0.277 0.000 0.000 0.000 4.042 5.913 0.540 0.553 0.799
6 0.176 0.182 0.210 0.201 0.120 0.047 2.516 17.502 0.769 0.844 1.883
R2u R3u R4u R5u R6u R7u R8u RTu R1u. R2u. R3u. R4u.
1 1.793 1.560 0.998 0.806 0.701 0.886 1.018 23.740 0.132 0.072 0.067 0.043
2 1.336 0.758 1.076 1.148 0.693 0.091 0.025 13.207 0.227 0.355 0.060 0.075
3 1.723 1.803 2.130 1.826 1.512 0.610 0.309 23.848 0.180 0.081 0.071 0.048
4 1.824 1.471 1.846 0.907 0.442 0.467 0.374 18.915 0.158 0.117 0.084 0.095
5 0.773 1.026 0.502 0.140 0.000 0.000 0.000 6.479 0.114 0.053 0.095 0.055
6 1.655 1.724 1.245 1.085 0.909 0.520 0.178 18.447 0.200 0.137 0.104 0.074
R5u. R6u. R7u. R8u. RTu. R1m R2m R3m R4m R5m R6m R7m R8m
1 0.043 0.031 0.040 0.035 0.132 0.926 0.613 0.396 0.224 0.221 0.267 0.281 0.215
2 0.072 0.073 0.024 0.025 0.355 0.856 0.426 0.365 0.382 0.312 0.176 0.063 0.044
3 0.049 0.044 0.027 0.027 0.180 1.362 1.092 0.842 0.942 0.932 0.452 0.225 0.058
4 0.067 0.036 0.033 0.035 0.158 0.512 0.372 0.287 0.163 0.099 0.113 0.067 0.018
5 0.048 0.000 0.000 0.000 0.114 1.183 1.372 2.638 1.361 0.829 0.000 0.000 0.000
6 0.061 0.045 0.042 0.034 0.200 0.978 0.593 0.472 0.398 0.315 0.204 0.094 0.008
RTm R1m. R2m. R3m. R4m. R5m. R6m. R7m. R8m. RTm. R1v R2v
1 6.916 0.066 0.040 0.028 0.012 0.021 0.020 0.021 0.017 0.066 1.134 0.802
2 5.249 0.188 0.080 0.034 0.042 0.037 0.028 0.029 0.044 0.188 0.703 0.394
3 11.813 0.149 0.106 0.039 0.051 0.057 0.040 0.032 0.021 0.149 0.896 0.693
4 3.266 0.080 0.056 0.059 0.026 0.018 0.031 0.018 0.002 0.080 0.718 0.464
5 14.765 0.224 0.156 0.829 0.479 0.415 0.000 0.000 0.000 0.829 0.640 0.624
6 6.124 0.242 0.084 0.056 0.039 0.038 0.032 0.045 0.004 0.242 0.849 0.635
R3v R4v R5v R6v R7v R8v RTv R1v. R2v. R3v. R4v. R5v. R6v.
1 0.554 0.332 0.287 0.339 0.395 0.352 9.420 0.066 0.040 0.028 0.012 0.021 0.020
2 0.355 0.414 0.332 0.140 0.029 0.007 4.747 0.072 0.032 0.030 0.027 0.022 0.019
3 0.644 0.635 0.536 0.360 0.168 0.063 8.006 0.071 0.032 0.025 0.019 0.019 0.013
4 0.417 0.316 0.166 0.128 0.119 0.075 4.855 0.080 0.045 0.027 0.017 0.014 0.018
5 0.680 0.309 0.099 0.000 0.000 0.000 4.705 0.076 0.053 0.095 0.055 0.048 0.000
6 0.523 0.415 0.317 0.206 0.091 0.024 6.126 0.067 0.032 0.022 0.019 0.017 0.015
R7v. R8v. RTv. R1e R2e R3e R4e R5e R6e R7e R8e RTe
1 0.021 0.017 0.066 2.060 1.761 1.489 0.960 0.767 0.676 0.846 0.958 22.827
2 0.011 0.007 0.072 1.553 1.306 0.766 1.124 1.169 0.810 0.117 0.044 13.782
3 0.013 0.007 0.071 2.113 1.869 1.980 2.349 2.114 1.629 0.662 0.325 26.222
4 0.018 0.008 0.080 1.806 1.779 1.444 1.763 0.876 0.428 0.486 0.342 18.338
5 0.000 0.000 0.095 0.866 0.868 1.274 0.636 0.192 0.000 0.000 0.000 7.674
6 0.008 0.006 0.067 2.021 1.686 1.704 1.258 1.118 0.952 0.553 0.178 18.986
R1e. R2e. R3e. R4e. R5e. R6e. R7e. R8e. RTe. R1p R2p R3p R4p
1 0.124 0.064 0.059 0.038 0.038 0.029 0.035 0.031 0.124 1.236 0.892 0.636 0.386
2 0.214 0.315 0.053 0.082 0.074 0.091 0.030 0.044 0.315 0.740 0.446 0.375 0.451
3 0.225 0.105 0.088 0.055 0.057 0.040 0.033 0.026 0.225 0.965 0.764 0.742 0.707
4 0.149 0.104 0.074 0.084 0.060 0.032 0.041 0.031 0.149 0.829 0.547 0.500 0.414
5 0.107 0.067 0.152 0.088 0.076 0.000 0.000 0.000 0.152 0.731 0.739 0.920 0.437
6 0.250 0.121 0.093 0.081 0.054 0.056 0.052 0.042 0.250 0.904 0.702 0.591 0.461
R5p R6p R7p R8p RTp R1p. R2p. R3p. R4p. R5p. R6p. R7p.
1 0.324 0.372 0.443 0.413 10.663 0.066 0.040 0.028 0.012 0.021 0.020 0.021
2 0.384 0.155 0.028 0.005 5.165 0.086 0.052 0.030 0.027 0.027 0.019 0.010
3 0.593 0.404 0.184 0.076 8.893 0.071 0.032 0.025 0.023 0.021 0.013 0.013
4 0.211 0.149 0.142 0.101 5.867 0.080 0.045 0.027 0.017 0.014 0.018 0.018
5 0.152 0.000 0.000 0.000 5.959 0.094 0.066 0.146 0.084 0.073 0.000 0.000
6 0.359 0.242 0.113 0.032 6.818 0.067 0.032 0.021 0.019 0.017 0.015 0.009
R8p. RTp. nCp nCs nCt nCq nCrs nCrt nCrq nCar nCbH nCb. nCconj nR.Cp nR.Cs
1 0.017 0.066 0 0 0 0 0 0 0 21 14 4 0 0 0
2 0.005 0.086 1 0 0 0 0 0 0 6 3 3 0 0 0
3 0.008 0.071 1 2 1 0 2 1 0 2 0 0 0 0 0
4 0.010 0.080 0 0 0 0 0 0 0 0 0 0 3 1 1
5 0.000 0.146 0 0 0 0 0 0 0 6 2 4 0 0 0
6 0.008 0.067 1 1 0 0 0 0 0 8 4 2 0 0 0
nR.Ct nR.CH.X nR.C. nRNCO nArNCO nRSCN nArSCN nRNCS nArNCS nRCOOH nArCOOH
1 0 0 0 0 0 0 0 0 0 0 0
2 0 0 0 0 2 0 0 0 0 0 0
3 0 0 0 0 0 0 0 0 0 1 0
4 0 0 0 0 0 0 0 0 0 0 0
5 0 0 0 0 0 0 0 0 0 0 0
6 0 0 0 0 0 0 0 0 0 0 0
nRCOOR nArCOOR nRCONH2 nArCONH2 nRCONHR nArCONHR nRCONR2 nArCONR2 nROCON
1 0 0 0 0 0 0 0 0 0
2 0 0 0 0 0 0 0 0 0
3 0 0 0 0 0 0 1 0 0
4 1 0 0 0 0 0 0 0 0
5 0 0 0 0 0 0 0 0 0
6 0 0 0 0 0 0 0 0 0
nArOCON nRCOX nArCOX nArCOSR nRCHO nArCHO nRCO nArCO nCONN nC.O.O.2 nN.C.N.
1 0 0 0 0 0 0 0 0 0 0 0
2 0 0 0 0 0 0 0 0 0 0 0
3 0 0 0 0 0 0 0 0 0 0 0
4 0 0 0 0 0 0 0 0 0 0 0
5 0 0 0 0 0 0 0 0 0 0 0
6 0 0 0 0 0 0 0 0 0 0 0
nC..N.N2 nRC.N nArC.N nRCNO nArCNO nRNH2 nArNH2 nRNHR nArNHR nRNR2 nArNR2
1 0 0 0 0 0 0 0 0 0 0 0
2 0 0 0 0 0 0 0 0 0 0 0
3 0 0 0 0 0 0 0 0 0 0 0
4 0 0 0 0 0 0 0 0 0 1 0
5 0 0 0 0 0 0 0 0 0 0 0
6 0 0 0 0 0 0 0 0 0 0 0
nN.N nN.N.1 nRCN nArCN nN. nNq nRNHO nArNHO nRNNOx nArNNOx nRNO nArNO nN.CO.2
1 0 0 0 0 0 0 0 0 0 0 0 0 0
2 0 0 0 0 0 0 0 0 0 0 0 0 0
3 0 0 0 0 0 0 0 0 0 0 0 0 0
4 0 0 0 0 0 0 0 0 0 0 0 0 0
5 0 0 0 0 0 0 0 0 0 0 0 0 0
6 0 0 0 0 0 0 0 0 0 0 0 0 0
nC.N.N. nROH nArOH nOHp nOHs nOHt nROR nArOR nO.C.O.2 nSH nRSR nRSSR nSO
1 0 0 0 0 0 0 0 1 0 0 0 0 0
2 0 0 0 0 0 0 0 0 0 0 0 0 0
3 0 1 0 0 0 0 0 0 0 0 0 0 0
4 0 0 0 0 0 0 0 0 0 0 0 0 0
5 0 0 0 0 0 0 0 0 0 0 0 0 0
6 0 1 0 1 0 0 0 0 0 0 0 0 0
nS..O.2 nSO2OH nSO3OH nSO2 nSO3 nSO4 nSO2N nPO3 nPO4 nPR3 nP..O.O2R
1 0 0 0 0 0 0 0 0 0 0 0
2 0 0 0 0 0 0 0 0 0 0 0
3 1 0 0 0 0 0 0 0 0 0 0
4 0 0 0 0 0 0 0 0 0 0 0
5 0 0 0 0 0 0 0 0 0 0 0
6 0 0 0 0 0 0 0 0 0 0 0
nP..O.R3.nPR5 nCH2RX nCHR2X nCR3X nR.CHX nR.CRX nCHRX2 nCR2X2 nR.CX2 nCRX3
1 0 0 0 0 0 0 0 0 0 0
2 0 0 0 0 0 0 0 0 0 0
3 0 0 0 0 0 0 0 0 0 0
4 0 0 0 0 0 0 0 0 0 0
5 0 0 0 0 0 0 0 0 0 0
6 0 0 0 0 0 0 0 0 0 0
nArX nCXr nCXr. nCconjX nAziridines nOxiranes nThiranes nOxetanes
1 0 0 0 0 0 0 0 0
2 0 0 0 0 0 0 0 0
3 0 0 0 0 0 0 0 0
4 0 0 0 0 0 0 0 0
5 4 0 0 0 0 0 0 0
6 0 0 0 0 0 0 0 0
nBeta.Lactams nPyrrolidines nOxolanes ntH.Thiophenes nPyrroles nPyrazoles
1 0 0 0 0 0 0
2 0 0 0 0 0 0
3 1 0 0 0 0 0
4 0 0 0 0 0 0
5 0 0 0 0 0 0
6 0 0 0 0 1 0
nImidazoles nFuranes nThiophenes nOxazoles nIsoxazoles nThiazoles
1 1 0 0 0 0 0
2 0 0 0 0 0 0
3 0 0 0 0 0 0
4 0 0 0 0 0 0
5 0 0 0 0 0 0
6 0 0 0 0 0 0
nIsothiazoles nTriazoles nPyridines nPyridazines nPyrimidines nPyrazines
1 0 0 0 0 0 0
2 0 0 0 0 0 0
3 0 1 0 0 0 0
4 0 0 0 0 0 0
5 0 0 0 0 0 0
6 0 0 0 0 0 0
n135.Triazines nHDon nHAcc nHBonds C.001 C.002 C.003 C.004 C.005 C.006 C.007
1 0 1 2 0 0 0 0 0 1 0 0
2 0 0 4 0 1 0 0 0 0 0 0
3 0 1 8 0 1 1 0 0 0 1 0
4 0 0 3 0 0 0 0 0 2 2 0
5 0 0 0 0 0 0 0 0 0 0 0
6 0 1 3 0 0 1 0 0 0 1 0
C.008 C.009 C.010 C.011 C.012 C.013 C.014 C.015 C.016 C.017 C.018 C.019 C.020
1 0 0 0 0 0 0 0 0 0 0 0 0 0
2 0 0 0 0 0 0 0 0 0 0 0 0 0
3 1 1 0 1 0 0 0 0 0 0 0 0 0
4 0 0 0 0 0 0 0 1 1 0 0 0 0
5 0 0 0 0 0 0 0 0 0 0 0 0 0
6 0 0 0 0 0 0 0 0 0 0 0 0 0
C.021 C.022 C.024 C.025 C.026 C.027 C.028 C.029 C.030 C.031 C.032 C.033 C.034
1 0 0 14 3 1 0 1 0 0 0 0 0 1
2 0 0 3 1 2 0 0 0 0 0 0 0 0
3 0 0 0 0 0 1 0 0 0 0 0 1 0
4 0 0 0 0 0 0 0 0 0 0 0 0 0
5 0 0 2 0 4 0 0 0 0 0 0 0 0
6 0 0 4 2 0 0 0 0 0 0 0 1 1
C.035 C.036 C.037 C.038 C.039 C.040 C.041 C.042 C.043 C.044 H.046 H.047 H.048
1 0 0 0 0 0 0 0 0 1 0 0 17 0
2 0 0 0 0 0 2 0 0 0 0 3 3 0
3 0 0 0 0 0 2 0 0 0 0 0 3 2
4 0 0 0 0 0 1 0 0 0 0 0 13 0
5 0 0 0 0 0 0 0 0 0 0 0 2 0
6 0 0 0 0 0 0 0 0 0 0 0 6 1
H.049 H.050 H.051 H.052 H.053 H.054 H.055 O.056 O.057 O.058 O.059 O.060 O.063
1 0 1 0 0 0 0 0 0 0 0 0 1 0
2 0 0 0 0 0 0 0 0 0 2 0 0 0
3 1 1 2 3 0 0 0 0 1 4 0 0 0
4 0 0 0 0 0 0 0 0 0 1 0 1 0
5 0 0 0 0 0 0 0 0 0 0 0 0 0
6 0 1 0 2 0 0 0 1 0 1 0 0 0
N.066 N.067 N.068 N.069 N.070 N.071 N.072 N.073 N.074 N.075 N.076 N.078 N.079
1 0 0 0 0 0 0 0 1 0 1 0 0 0
2 0 0 0 0 0 0 0 0 2 0 0 0 0
3 0 0 0 0 0 0 1 1 0 2 0 0 0
4 0 0 1 0 0 0 0 0 0 0 0 0 0
5 0 0 0 0 0 0 0 0 0 0 0 0 0
6 0 0 0 0 0 0 0 1 0 0 0 1 0
F.081 F.082 F.083 F.084 F.085 Cl.086 Cl.087 Cl.088 Cl.089 Cl.090 Br.091
1 0 0 0 0 0 0 0 0 0 0 0
2 0 0 0 0 0 0 0 0 0 0 0
3 0 0 0 0 0 0 0 0 0 0 0
4 0 0 0 0 0 0 0 0 0 0 0
5 0 0 0 0 0 0 0 0 4 0 0
6 0 0 0 0 0 0 0 0 0 0 0
Br.092 Br.094 Br.095 I.096 I.097 I.099 S.106 S.107 S.108 S.109 S.110 P.117
1 0 0 0 0 0 0 0 0 0 0 0 0
2 0 0 0 0 0 0 0 0 0 0 0 0
3 0 0 0 0 0 0 0 0 0 0 1 0
4 0 0 0 0 0 0 0 0 0 0 0 0
5 0 0 0 0 0 0 0 0 0 0 0 0
6 0 0 0 0 0 0 0 0 0 0 0 0
P.118 P.119 P.120 Ui Hy AMR TPSA.NO. TPSA.Tot. MLOGP MLOGP2 ALOGP
1 0 0 0 4.585 -0.435 99.867 37.91 37.91 4.678 21.887 5.383
2 0 0 0 3.459 -0.673 45.215 58.86 58.86 1.539 2.368 2.037
3 0 0 0 3.322 -0.025 65.983 122.46 130.84 -0.009 0.000 -1.107
4 0 0 0 1.585 -0.672 40.155 29.54 29.54 0.783 0.614 0.857
5 0 0 0 2.807 -0.576 45.277 0.00 0.00 4.634 21.476 4.488
6 0 0 0 3.585 -0.166 54.072 54.59 54.59 1.469 2.157 2.341
ALOGP2 LAI GVWAI.80 GVWAI.50 Inflammat.80 Inflammat.50 Depressant.80
1 28.972 0 1 0 0 0 0
2 4.149 0 0 0 0 0 0
3 1.225 0 0 0 0 0 0
4 0.735 0 0 0 0 0 0
5 20.139 0 0 0 0 0 0
6 5.482 0 1 0 0 0 0
Depressant.50 Psychotic.80 Psychotic.50 Hypertens.80 Hypertens.50 Hypnotic.80
1 0 0 0 0 0 0
2 0 0 0 0 0 0
3 0 0 0 0 0 0
4 0 0 0 0 0 0
5 0 0 0 0 0 0
6 0 0 0 0 0 1
Hypnotic.50 Neoplastic.80 Neoplastic.50 Infective.80 Infective.50 BLTF96
1 0 0 0 0 0 -5.37
2 0 0 0 1 0 -2.70
3 0 1 0 0 0 -1.38
4 0 0 0 0 0 -2.06
5 0 0 0 1 0 -5.33
6 0 1 0 1 0 -2.64
BLTD48 BLTA96 ClogP
1 -5.76 -5.91 5.687
2 -2.78 -2.77 3.267
3 -1.31 -1.22 -0.652
4 -2.06 -2.01 0.966
5 -5.72 -5.86 4.754
6 -2.72 -2.70 0.687
Add the following code to your website.
For more information on customizing the embed code, read Embedding Snippets.