0 mol 1 unq 0 iso 0 dist 8.40848 8.27735 6.35409 9.40273 7.21349 12.7552 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 6.42206 7.34549 5.3315 4.20567 8.6112 10.8071 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 9.66602 9.72289 5.3315 9.87081 8.6112 10.8071 numMergedOcc 0
3 mol 78 unq 0 iso 0 dist 8.61468 9.45835 7.17843 14.2261 9.53794 14.6085 numMergedOcc 0
4 mol 78 unq 1 iso 0 dist 8.61468 9.45835 7.17843 11.1106 9.84346 9.23023 numMergedOcc 0
5 mol 78 unq 2 iso 0 dist 6.27186 9.45835 4.4651 11.1106 9.46472 9.23023 numMergedOcc 0
6 mol 79 unq 0 iso 0 dist 9.04935 7.79726 12.1055 5.87135 7.74131 13.1498 numMergedOcc 0
7 mol 113 unq 0 iso 0 dist 8.28452 8.29529 14.0364 6.68968 9.64281 8.89481 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 5.7232 8.94909 5.37072 6.45157 7.12336 5.86531 numMergedOcc 0
9 mol 183 unq 0 iso 0 dist 8.53483 9.09322 7.79648 5.27994 8.15747 12.5879 numMergedOcc 0
10 mol 183 unq 1 iso 0 dist 8.53483 9.09322 7.79648 13.4834 5.44125 10.342 numMergedOcc 0
11 mol 183 unq 2 iso 0 dist 8.50695 9.60723 6.50505 9.60638 8.7143 10.342 numMergedOcc 0
12 mol 185 unq 0 iso 0 dist 6.06763 6.62848 4.53126 11.8032 9.56016 13.8686 numMergedOcc 0
13 mol 185 unq 1 iso 0 dist 6.06763 6.62848 4.53126 10.8076 7.92501 11.0291 numMergedOcc 0
14 mol 196 unq 0 iso 0 dist 5.76319 7.84536 4.57882 7.42251 7.556 6.25429 numMergedOcc 0
15 mol 196 unq 1 iso 0 dist 5.30132 7.07723 4.57882 10.0417 7.556 6.25429 numMergedOcc 0
16 mol 196 unq 2 iso 0 dist 8.36119 8.69629 6.70722 7.06113 7.556 6.87731 numMergedOcc 0
17 mol 258 unq 0 iso 0 dist 8.62592 5.31858 7.52881 8.95242 8.37512 10.3938 numMergedOcc 0
18 mol 258 unq 1 iso 0 dist 8.62592 5.71851 12.3042 8.95242 8.37512 13.2881 numMergedOcc 0
19 mol 259 unq 0 iso 0 dist 8.93002 5.29682 6.64729 6.00285 9.05363 5.90645 numMergedOcc 0
20 mol 259 unq 1 iso 0 dist 8.93002 6.20344 9.79538 6.00285 9.05363 9.73107 numMergedOcc 0
21 mol 259 unq 2 iso 0 dist 6.83706 8.69345 10.7398 11.3955 5.30455 14.3063 numMergedOcc 0
22 mol 259 unq 3 iso 0 dist 6.83706 8.69345 10.7398 9.8442 6.8184 14.8493 numMergedOcc 0
23 mol 265 unq 0 iso 0 dist 9.83854 7.45719 5.58514 13.5626 9.71346 13.2527 numMergedOcc 0
24 mol 292 unq 0 iso 0 dist 5.76223 8.44108 9.68222 11.6897 8.35169 17.7828 numMergedOcc 0
