0 mol 17 unq 0 iso 0 dist 5.41678 8.44037 5.22923 9.13617 8.58468 6.64199 numMergedOcc 0
1 mol 17 unq 1 iso 0 dist 5.41678 8.44037 5.22923 4.88828 7.95007 8.90155 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 9.10233 8.63439 12.9685 6.69874 12.9992 9.54171 numMergedOcc 0
3 mol 42 unq 0 iso 0 dist 9.19217 7.73997 4.12203 5.6382 9.50049 9.39402 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 8.9175 9.80453 3.42062 15.0045 7.99735 7.90416 numMergedOcc 0
5 mol 62 unq 0 iso 0 dist 6.75432 5.23167 3.70802 4.29159 6.30202 7.01397 numMergedOcc 0
6 mol 62 unq 1 iso 0 dist 8.45469 5.23167 3.66673 4.29159 10.1974 7.01397 numMergedOcc 0
7 mol 71 unq 0 iso 0 dist 7.56624 6.5009 6.01777 4.49345 7.92957 9.69397 numMergedOcc 0
8 mol 81 unq 0 iso 0 dist 6.80165 7.94697 5.53904 4.76773 8.78612 8.57764 numMergedOcc 0
9 mol 85 unq 0 iso 0 dist 6.24764 7.61514 3.81285 9.04544 9.37034 8.67342 numMergedOcc 0
10 mol 85 unq 1 iso 0 dist 6.24764 7.61514 3.81285 4.11312 6.60091 5.73739 numMergedOcc 0
11 mol 85 unq 2 iso 0 dist 6.24764 8.21116 6.17121 9.04544 9.37034 8.60062 numMergedOcc 0
12 mol 85 unq 3 iso 0 dist 6.24764 8.21116 6.17121 4.11312 6.60091 5.16225 numMergedOcc 0
13 mol 90 unq 0 iso 0 dist 9.25793 7.30934 3.79142 9.63545 9.69413 7.01987 numMergedOcc 0
14 mol 152 unq 0 iso 0 dist 9.44435 9.3776 5.0146 4.91732 9.07154 8.52131 numMergedOcc 0
15 mol 169 unq 0 iso 0 dist 9.28392 6.18165 13.6106 12.2667 18.0446 6.27378 numMergedOcc 0
16 mol 176 unq 0 iso 0 dist 4.60553 9.1617 7.10617 12.7186 13.8196 9.1728 numMergedOcc 0
17 mol 176 unq 1 iso 0 dist 7.06005 6.32254 3.75017 13.0176 12.2516 9.60931 numMergedOcc 0
18 mol 225 unq 0 iso 0 dist 9.21721 6.15671 6.46348 5.97855 10.9199 6.35772 numMergedOcc 0
19 mol 281 unq 0 iso 0 dist 9.79394 8.78416 3.86368 13.3861 7.90993 9.39268 numMergedOcc 0
20 mol 281 unq 1 iso 0 dist 9.79394 8.78416 3.86368 8.97987 12.6298 9.06888 numMergedOcc 0
21 mol 281 unq 2 iso 0 dist 9.79394 9.22428 7.4282 8.97987 12.6298 6.62682 numMergedOcc 0
22 mol 281 unq 3 iso 0 dist 6.52115 7.82358 3.86368 3.90611 7.90993 9.39268 numMergedOcc 0
23 mol 281 unq 4 iso 0 dist 6.52115 7.82358 3.86368 13.4167 12.6298 9.06888 numMergedOcc 0
