0 mol 9 unq 0 iso 0 dist 7.25179 7.95202 4.61049 13.7 8.57077 12.6047 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 7.25179 6.75249 6.64015 13.7 8.57077 14.9473 numMergedOcc 0
2 mol 9 unq 2 iso 0 dist 8.72522 6.21942 4.61049 16.5569 8.57077 12.6047 numMergedOcc 0
3 mol 9 unq 3 iso 0 dist 8.72522 6.38082 6.64015 16.5569 8.57077 14.9473 numMergedOcc 0
4 mol 18 unq 0 iso 0 dist 8.51213 5.03976 7.04695 11.0081 9.51761 12.3965 numMergedOcc 0
5 mol 18 unq 1 iso 0 dist 8.51213 5.03976 7.04695 11.3758 7.3094 12.8594 numMergedOcc 0
6 mol 26 unq 0 iso 0 dist 7.34549 9.08976 11.887 4.76147 8.34347 9.16962 numMergedOcc 0
7 mol 41 unq 0 iso 0 dist 9.02927 7.41523 5.0364 14.1634 6.19529 9.68811 numMergedOcc 0
8 mol 58 unq 0 iso 0 dist 7.66055 8.42365 8.48255 5.76106 6.81627 10.947 numMergedOcc 0
9 mol 90 unq 0 iso 0 dist 6.31203 9.25984 4.88519 4.53359 5.83409 10.2947 numMergedOcc 0
10 mol 115 unq 0 iso 0 dist 5.11612 9.36283 6.34759 10.3475 9.33865 12.0409 numMergedOcc 0
11 mol 115 unq 1 iso 0 dist 5.11612 9.36283 6.34759 6.86762 5.83991 11.8557 numMergedOcc 0
12 mol 117 unq 0 iso 0 dist 9.60425 9.77482 11.3679 5.17524 9.84395 6.62561 numMergedOcc 0
13 mol 117 unq 1 iso 0 dist 9.60425 9.0428 15.2823 5.17524 9.84395 13.4462 numMergedOcc 0
14 mol 152 unq 0 iso 0 dist 9.37459 9.65224 9.73393 8.41711 5.87555 13.311 numMergedOcc 0
15 mol 152 unq 1 iso 0 dist 9.37459 9.65224 9.73393 4.82496 8.87437 13.2965 numMergedOcc 0
16 mol 152 unq 2 iso 0 dist 9.0847 9.65224 12.8308 14.8573 8.56324 19.7601 numMergedOcc 0
17 mol 152 unq 3 iso 0 dist 9.0847 9.65224 12.8308 8.41711 6.70283 13.311 numMergedOcc 0
18 mol 152 unq 4 iso 0 dist 9.0847 9.65224 12.8308 4.82496 7.16148 13.2965 numMergedOcc 0
19 mol 152 unq 5 iso 0 dist 6.00061 9.65224 6.56944 8.41711 8.67331 13.311 numMergedOcc 0
20 mol 152 unq 6 iso 0 dist 6.00061 9.65224 6.56944 4.82496 8.05741 13.2965 numMergedOcc 0
21 mol 178 unq 0 iso 0 dist 7.14849 8.71031 5.25267 6.96904 6.69288 10.5498 numMergedOcc 0
22 mol 178 unq 1 iso 0 dist 7.14849 8.71031 5.25267 7.57303 6.43573 11.4139 numMergedOcc 0
23 mol 178 unq 2 iso 0 dist 7.14849 8.71031 5.25267 14.0459 7.17202 10.2288 numMergedOcc 0
24 mol 178 unq 3 iso 0 dist 7.14849 8.71031 5.25267 14.3001 8.81551 11.4815 numMergedOcc 0
25 mol 181 unq 0 iso 0 dist 9.50454 7.82604 8.93318 11.755 7.63312 14.6987 numMergedOcc 0
26 mol 181 unq 1 iso 0 dist 9.50454 8.22583 9.60512 11.755 7.63312 7.98142 numMergedOcc 0
27 mol 181 unq 2 iso 0 dist 7.15963 7.82604 8.25067 14.1493 9.1374 13.2702 numMergedOcc 0
28 mol 181 unq 3 iso 0 dist 7.15963 7.82604 8.25067 6.73556 5.98885 10.8351 numMergedOcc 0
29 mol 181 unq 4 iso 0 dist 7.15963 7.82604 8.25067 5.49666 9.15386 9.6668 numMergedOcc 0
30 mol 181 unq 5 iso 0 dist 7.15963 8.22583 14.8479 14.1493 9.1374 21.3196 numMergedOcc 0
31 mol 181 unq 6 iso 0 dist 7.15963 8.22583 14.8479 6.73556 5.98885 14.4372 numMergedOcc 0
32 mol 181 unq 7 iso 0 dist 7.15963 8.22583 14.8479 5.49666 9.15386 10.7202 numMergedOcc 0
33 mol 196 unq 0 iso 0 dist 8.69629 8.2424 7.02839 4.76275 9.62191 11.6278 numMergedOcc 0
34 mol 205 unq 0 iso 0 dist 6.04106 9.70674 6.23291 12.9245 7.26832 9.19704 numMergedOcc 0
35 mol 210 unq 0 iso 0 dist 7.86668 6.94875 11.9386 5.06314 6.18308 10.1086 numMergedOcc 0
36 mol 234 unq 0 iso 0 dist 4.91961 6.553 5.56749 11.5103 9.45496 15.004 numMergedOcc 0
37 mol 234 unq 1 iso 0 dist 4.91961 6.553 5.56749 4.98993 6.7625 10.8628 numMergedOcc 0
38 mol 234 unq 2 iso 0 dist 4.91961 6.5097 7.50943 11.5103 9.45496 16.1247 numMergedOcc 0
39 mol 234 unq 3 iso 0 dist 4.91961 6.5097 7.50943 4.98993 6.7625 11.1284 numMergedOcc 0
40 mol 238 unq 0 iso 0 dist 8.39522 6.59305 6.20606 4.88998 6.57393 5.38637 numMergedOcc 0
41 mol 238 unq 1 iso 0 dist 5.99187 6.59305 10.4664 5.74685 6.22714 10.5202 numMergedOcc 0
42 mol 238 unq 2 iso 0 dist 5.99187 6.59305 10.4664 5.87189 7.31233 6.55759 numMergedOcc 0
43 mol 243 unq 0 iso 0 dist 4.89168 9.85284 7.12868 6.50608 8.23192 14.7694 numMergedOcc 0
44 mol 265 unq 0 iso 0 dist 6.78702 7.74463 6.43013 4.75685 8.4218 6.34034 numMergedOcc 0
45 mol 265 unq 1 iso 0 dist 8.59825 5.88787 5.51535 11.5105 8.4218 12.4545 numMergedOcc 0
