0 mol 0 unq 0 iso 0 dist 7.65806 9.72725 6.0225 10.5877 10.5603 5.88757 9.64573 9.19007 6.94943 4.62412 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 7.65806 9.72725 6.0225 14.2251 10.4406 8.66548 9.64573 9.19007 6.94943 5.96303 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 8.57077 5.8245 5.84314 8.27962 6.85412 9.71516 3.98483 9.78006 7.05919 7.98363 numMergedOcc 0
3 mol 9 unq 1 iso 0 dist 8.57077 5.8245 5.84314 11.4878 6.33889 9.81658 3.98483 9.78006 7.05919 10.4204 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 6.64012 9.08221 4.00553 11.6697 10.5905 8.13051 6.37648 7.27383 6.87028 5.36808 numMergedOcc 0
5 mol 58 unq 1 iso 0 dist 9.4099 9.08221 8.55984 11.6697 15.9825 8.13051 6.37648 12.5444 6.87028 5.36808 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 9.33898 7.06939 4.3481 6.61299 11.9364 9.39807 6.08245 6.61823 6.9223 7.24263 numMergedOcc 0
7 mol 92 unq 1 iso 0 dist 9.33898 7.06939 4.3481 6.61299 11.9364 9.39807 6.86728 6.49956 7.0561 12.5937 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 5.08437 5.10496 3.9764 8.70415 10.417 6.61111 7.32662 7.26086 8.75597 13.6622 numMergedOcc 0
9 mol 98 unq 1 iso 0 dist 5.08437 5.10496 3.9764 8.70415 10.417 6.61111 12.3881 12.285 9.18457 6.34014 numMergedOcc 0
10 mol 98 unq 2 iso 0 dist 6.48948 5.92242 3.9764 9.74284 10.417 6.61111 13.4985 7.26086 8.75597 13.6622 numMergedOcc 0
11 mol 98 unq 3 iso 0 dist 6.48948 5.92242 3.9764 9.74284 10.417 6.61111 7.89505 12.285 9.18457 6.34014 numMergedOcc 0
12 mol 98 unq 4 iso 0 dist 6.10456 7.54889 10.4782 10.0962 10.417 4.44979 13.9572 15.6191 6.83746 5.92812 numMergedOcc 0
13 mol 98 unq 5 iso 0 dist 6.10456 7.54889 10.4782 10.0962 10.417 4.44979 13.1975 12.285 9.14707 6.34014 numMergedOcc 0
14 mol 98 unq 6 iso 0 dist 6.10456 5.2571 3.9764 10.0962 10.417 6.61111 6.934 7.26086 8.75597 13.6622 numMergedOcc 0
15 mol 98 unq 7 iso 0 dist 6.10456 5.2571 3.9764 10.0962 10.417 6.61111 13.1975 12.285 9.18457 6.34014 numMergedOcc 0
16 mol 119 unq 0 iso 0 dist 8.73993 7.64052 9.68677 10.0197 14.0269 6.13374 3.78311 7.77116 9.57341 11.1324 numMergedOcc 0
17 mol 119 unq 1 iso 0 dist 8.73993 7.64052 9.68677 10.6679 9.63176 9.08536 3.78311 7.77116 9.57341 8.96522 numMergedOcc 0
18 mol 119 unq 2 iso 0 dist 9.87172 6.99446 6.20019 6.35763 6.19042 6.13374 4.99056 13.1741 9.57341 11.1324 numMergedOcc 0
19 mol 119 unq 3 iso 0 dist 9.87172 6.99446 6.20019 7.36192 7.44174 9.08536 4.99056 13.1741 9.57341 8.96522 numMergedOcc 0
20 mol 119 unq 4 iso 0 dist 6.18601 8.95212 4.39676 10.3457 8.43904 6.13374 13.52 12.6868 9.57341 11.1324 numMergedOcc 0
21 mol 119 unq 5 iso 0 dist 6.18601 8.95212 4.39676 16.7975 13.4411 9.08536 13.52 12.6868 9.57341 8.96522 numMergedOcc 0
22 mol 134 unq 0 iso 0 dist 8.94367 9.33094 7.41373 5.3585 11.2292 7.43401 9.4027 8.20836 5.11043 8.05714 numMergedOcc 0
23 mol 134 unq 1 iso 0 dist 6.37586 9.33094 10.8635 5.3585 10.9613 7.43401 9.4027 10.873 5.11043 8.05714 numMergedOcc 0
24 mol 134 unq 2 iso 0 dist 6.49416 9.33094 12.3479 5.3585 10.9685 7.43401 9.4027 13.846 5.11043 8.05714 numMergedOcc 0
25 mol 134 unq 3 iso 0 dist 9.86662 9.1998 12.8086 6.74887 11.2292 6.44575 5.12325 8.20836 6.99345 8.05714 numMergedOcc 0
26 mol 134 unq 4 iso 0 dist 9.86662 8.69531 7.41373 6.74887 11.2292 7.43401 5.12325 8.20836 5.11043 8.05714 numMergedOcc 0
27 mol 134 unq 5 iso 0 dist 9.71307 9.1998 15.0225 6.74887 10.9613 6.44575 5.12325 10.873 6.99345 8.05714 numMergedOcc 0
28 mol 134 unq 6 iso 0 dist 9.71307 8.69531 10.8635 6.74887 10.9613 7.43401 5.12325 10.873 5.11043 8.05714 numMergedOcc 0
29 mol 143 unq 0 iso 0 dist 5.99315 5.40637 7.39837 5.44503 9.93541 7.46803 10.8441 13.4668 8.68663 7.12863 numMergedOcc 0
30 mol 224 unq 0 iso 0 dist 6.61986 8.08349 5.13732 10.7113 8.19953 5.73591 4.59567 8.37597 8.54702 8.5129 numMergedOcc 0
31 mol 224 unq 1 iso 0 dist 6.61986 8.08349 5.13732 11.4491 11.5717 8.55345 4.59567 8.37597 8.54702 7.96876 numMergedOcc 0
32 mol 234 unq 0 iso 0 dist 9.45496 7.81215 12.4252 5.56749 15.004 9.11572 11.113 18.9709 9.08151 8.16702 numMergedOcc 0
33 mol 234 unq 1 iso 0 dist 9.45496 7.81215 12.4252 15.015 21.615 9.49229 11.113 18.9709 9.08151 9.70708 numMergedOcc 0
34 mol 234 unq 2 iso 0 dist 9.45496 7.81215 12.4252 12.1076 17.6567 7.20293 11.113 18.9709 9.08151 11.7632 numMergedOcc 0
35 mol 234 unq 3 iso 0 dist 6.7625 7.81215 5.75498 5.56749 10.8628 9.11572 11.113 11.968 9.08151 8.16702 numMergedOcc 0
36 mol 234 unq 4 iso 0 dist 6.7625 7.81215 5.75498 15.015 15.1691 9.49229 11.113 11.968 9.08151 9.70708 numMergedOcc 0
37 mol 234 unq 5 iso 0 dist 6.7625 7.81215 5.75498 12.1076 12.6312 7.20293 11.113 11.968 9.08151 11.7632 numMergedOcc 0
38 mol 238 unq 0 iso 0 dist 5.72887 9.72188 7.06793 15.5674 15.9735 9.84652 10.7551 11.2809 6.53286 5.88491 numMergedOcc 0
39 mol 238 unq 1 iso 0 dist 7.31233 9.12776 10.3162 8.82861 9.38422 9.84652 11.0349 11.9624 6.53286 5.88491 numMergedOcc 0
