0 mol 8 unq 0 iso 0 dist 9.52805 5.89089 5.12111 8.14585 6.68292 4.94497 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 9.52805 9.78638 10.7532 8.14585 6.68292 5.61772 numMergedOcc 0
2 mol 17 unq 0 iso 0 dist 8.19749 9.55169 9.91781 9.84612 10.2527 5.67637 numMergedOcc 0
3 mol 17 unq 1 iso 0 dist 8.19749 9.55169 9.91781 9.31884 4.61249 13.2554 numMergedOcc 0
4 mol 17 unq 2 iso 0 dist 8.19749 9.45609 11.2397 9.84612 10.2527 17.5301 numMergedOcc 0
5 mol 17 unq 3 iso 0 dist 8.19749 9.45609 11.2397 9.31884 4.61249 9.36146 numMergedOcc 0
6 mol 52 unq 0 iso 0 dist 5.77748 9.02308 10.3287 6.68656 5.09324 6.66056 numMergedOcc 0
7 mol 52 unq 1 iso 0 dist 7.33436 6.08894 6.03647 8.72923 10.4823 6.66056 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 3.90209 9.58693 12.3572 9.66226 8.83348 19.0994 numMergedOcc 0
9 mol 98 unq 1 iso 0 dist 3.90209 9.48388 7.71768 9.66226 8.83348 7.28361 numMergedOcc 0
10 mol 100 unq 0 iso 0 dist 5.72842 7.02792 7.68675 8.11279 11.4018 4.97045 numMergedOcc 0
11 mol 102 unq 0 iso 0 dist 7.58293 5.79411 5.09542 8.48638 9.38204 4.48396 numMergedOcc 0
12 mol 102 unq 1 iso 0 dist 7.58293 9.9404 6.14255 8.48638 9.38204 6.89494 numMergedOcc 0
13 mol 171 unq 0 iso 0 dist 4.46397 8.68992 9.02044 6.08141 9.21862 5.90026 numMergedOcc 0
14 mol 173 unq 0 iso 0 dist 8.82137 9.72828 9.29369 7.3879 10.735 5.27321 numMergedOcc 0
15 mol 173 unq 1 iso 0 dist 8.82137 9.72828 9.29369 9.70728 14.6187 8.07089 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 9.92602 6.20985 5.93294 9.56023 14.1678 8.98536 numMergedOcc 0
17 mol 222 unq 0 iso 0 dist 7.91542 6.82584 5.05771 8.81874 10.4864 6.37513 numMergedOcc 0
18 mol 233 unq 0 iso 0 dist 7.67027 4.94074 9.8029 5.83278 5.67483 5.01307 numMergedOcc 0
19 mol 234 unq 0 iso 0 dist 8.70264 8.58958 7.01488 8.88567 13.2928 15.6307 numMergedOcc 0
20 mol 234 unq 1 iso 0 dist 8.70264 8.58958 7.01488 9.45787 16.2735 13.8349 numMergedOcc 0
21 mol 234 unq 2 iso 0 dist 8.70264 7.17987 7.54044 8.88567 13.2928 10.998 numMergedOcc 0
22 mol 234 unq 3 iso 0 dist 8.70264 7.17987 7.54044 9.45787 16.2735 10.0059 numMergedOcc 0
23 mol 241 unq 0 iso 0 dist 8.67571 5.57621 10.0597 5.50061 5.71704 4.90279 numMergedOcc 0
24 mol 271 unq 0 iso 0 dist 7.88092 7.59727 5.31774 8.97962 13.0448 8.66946 numMergedOcc 0
25 mol 275 unq 0 iso 0 dist 9.80175 9.94511 8.14605 6.88967 4.96922 4.33371 numMergedOcc 0
26 mol 287 unq 0 iso 0 dist 9.77903 6.38062 5.59624 9.63769 10.8128 8.39288 numMergedOcc 0
27 mol 287 unq 1 iso 0 dist 9.39145 6.38062 11.3986 9.63769 6.25179 8.39288 numMergedOcc 0
28 mol 288 unq 0 iso 0 dist 9.77903 6.38062 5.59624 9.63769 10.8128 8.39288 numMergedOcc 0
29 mol 288 unq 1 iso 0 dist 9.39145 6.38062 11.3986 9.63769 6.25179 8.39288 numMergedOcc 0
30 mol 289 unq 0 iso 0 dist 9.77903 6.38062 5.59624 9.63769 10.8128 8.39288 numMergedOcc 0
31 mol 289 unq 1 iso 0 dist 9.39145 6.38062 11.3986 9.63769 6.25179 8.39288 numMergedOcc 0
