0 mol 11 unq 0 iso 0 dist 6.49709 5.59847 4.10106 4.4067 8.68293 9.32171 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 6.49709 5.59847 4.10106 13.2938 6.84216 9.89425 numMergedOcc 0
2 mol 18 unq 0 iso 0 dist 5.32149 8.1133 4.59668 4.86477 9.1397 12.7664 numMergedOcc 0
3 mol 18 unq 1 iso 0 dist 5.32149 8.44727 5.67577 4.86477 9.1397 9.46349 numMergedOcc 0
4 mol 41 unq 0 iso 0 dist 5.36895 4.29713 7.18662 6.85618 9.17982 8.90309 numMergedOcc 0
5 mol 41 unq 1 iso 0 dist 5.36895 4.29713 7.18662 8.25624 9.62869 12.5127 numMergedOcc 0
6 mol 41 unq 2 iso 0 dist 5.36895 4.29713 7.18662 5.36021 6.40219 5.47447 numMergedOcc 0
7 mol 43 unq 0 iso 0 dist 8.06275 8.74209 5.41726 7.62357 9.02471 12.649 numMergedOcc 0
8 mol 72 unq 0 iso 0 dist 9.43143 9.73435 4.03844 10.2533 4.86198 8.77831 numMergedOcc 0
9 mol 78 unq 0 iso 0 dist 9.29446 8.56119 9.76194 13.5358 7.69072 16.4844 numMergedOcc 0
10 mol 95 unq 0 iso 0 dist 7.90775 7.84956 7.45908 6.56529 7.51733 11.5632 numMergedOcc 0
11 mol 95 unq 1 iso 0 dist 7.90775 8.57607 4.99174 6.56529 7.51733 4.3439 numMergedOcc 0
12 mol 95 unq 2 iso 0 dist 7.90775 6.1991 4.46005 6.56529 7.51733 6.05855 numMergedOcc 0
13 mol 95 unq 3 iso 0 dist 7.90775 5.96246 8.28518 6.56529 7.51733 11.1729 numMergedOcc 0
14 mol 122 unq 0 iso 0 dist 8.47907 6.91978 6.9791 12.1473 4.42563 10.2878 numMergedOcc 0
15 mol 152 unq 0 iso 0 dist 8.34839 9.4275 5.39112 14.1262 9.00072 10.6225 numMergedOcc 0
16 mol 152 unq 1 iso 0 dist 8.34839 9.83462 4.84714 14.1262 9.00072 12.4493 numMergedOcc 0
17 mol 154 unq 0 iso 0 dist 6.44195 8.59532 4.55687 5.71332 8.89394 10.4142 numMergedOcc 0
18 mol 169 unq 0 iso 0 dist 6.28961 8.89822 5.7891 12.9917 9.37946 4.11374 numMergedOcc 0
19 mol 169 unq 1 iso 0 dist 6.28961 8.89822 5.7891 12.2955 9.13646 8.37602 numMergedOcc 0
20 mol 169 unq 2 iso 0 dist 6.28961 8.89822 5.7891 11.6543 8.34216 10.7555 numMergedOcc 0
21 mol 178 unq 0 iso 0 dist 8.04723 8.81097 10.8373 12.3914 4.72821 15.0797 numMergedOcc 0
22 mol 186 unq 0 iso 0 dist 6.0639 9.16579 7.38602 4.59453 9.65093 13.1584 numMergedOcc 0
23 mol 186 unq 1 iso 0 dist 6.0639 8.95209 11.6282 4.59453 9.65093 9.4366 numMergedOcc 0
24 mol 195 unq 0 iso 0 dist 4.78641 6.27266 5.41635 4.65343 6.59544 10.4086 numMergedOcc 0
25 mol 206 unq 0 iso 0 dist 5.82039 9.36144 7.89575 12.4707 9.4629 13.8095 numMergedOcc 0
26 mol 232 unq 0 iso 0 dist 7.57253 8.1692 5.42461 11.393 8.25985 11.9458 numMergedOcc 0
27 mol 232 unq 1 iso 0 dist 7.57253 8.1692 5.42461 7.05941 9.27788 11.4714 numMergedOcc 0
28 mol 266 unq 0 iso 0 dist 6.95233 7.30349 6.17213 4.5731 9.29666 11.6442 numMergedOcc 0
29 mol 277 unq 0 iso 0 dist 8.53324 9.22453 4.40029 9.7252 7.42932 5.13533 numMergedOcc 0
30 mol 277 unq 1 iso 0 dist 7.23956 9.22453 3.97543 9.7252 4.9764 5.13533 numMergedOcc 0
31 mol 277 unq 2 iso 0 dist 7.23956 9.22453 3.97543 10.5201 6.36559 8.0969 numMergedOcc 0
32 mol 285 unq 0 iso 0 dist 6.44657 7.12723 10.8644 11.6832 6.71946 17.1783 numMergedOcc 0
33 mol 285 unq 1 iso 0 dist 6.44657 7.12723 10.8644 6.73715 8.28061 13.6983 numMergedOcc 0
34 mol 285 unq 2 iso 0 dist 6.44657 7.12723 10.8644 5.32175 5.03601 11.2031 numMergedOcc 0
