0 mol 12 unq 0 iso 0 dist 8.3933 9.32718 8.66166 6.16894 6.6051 10.4152 numMergedOcc 0
1 mol 12 unq 1 iso 0 dist 8.3933 9.32718 8.66166 5.93993 8.15864 10.6743 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 6.51779 5.79041 7.80011 7.75706 8.12541 12.0687 numMergedOcc 0
3 mol 33 unq 0 iso 0 dist 8.16593 8.52627 12.7651 10.2877 8.74487 18.0942 numMergedOcc 0
4 mol 33 unq 1 iso 0 dist 8.16593 8.52627 12.7651 11.0193 7.44828 14.2319 numMergedOcc 0
5 mol 42 unq 0 iso 0 dist 8.53522 9.4437 9.82579 4.8523 5.52834 10.9993 numMergedOcc 0
6 mol 128 unq 0 iso 0 dist 6.45731 6.12126 5.40594 12.523 8.64054 12.4428 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 8.58727 4.95674 13.0351 8.50536 8.8353 13.0242 numMergedOcc 0
8 mol 140 unq 0 iso 0 dist 8.75971 9.38836 6.57826 6.75517 8.94921 12.9329 numMergedOcc 0
9 mol 140 unq 1 iso 0 dist 8.75971 9.38836 6.57826 12.5812 7.77669 13.5695 numMergedOcc 0
10 mol 150 unq 0 iso 0 dist 7.66236 6.895 8.14618 9.42217 9.94845 14.9845 numMergedOcc 0
11 mol 157 unq 0 iso 0 dist 9.20602 8.73794 4.86515 10.7142 6.8976 10.6027 numMergedOcc 0
12 mol 189 unq 0 iso 0 dist 8.49075 9.76153 6.70589 5.92167 6.77641 9.41349 numMergedOcc 0
13 mol 189 unq 1 iso 0 dist 8.49075 7.2571 5.88642 5.92167 6.77641 4.96433 numMergedOcc 0
14 mol 206 unq 0 iso 0 dist 7.95458 8.65687 8.42007 7.18271 9.42047 9.5964 numMergedOcc 0
15 mol 266 unq 0 iso 0 dist 9.17075 9.15288 11.7017 13.8167 9.0836 15.187 numMergedOcc 0
16 mol 266 unq 1 iso 0 dist 9.17075 6.11795 14.4553 13.8167 9.0836 17.7532 numMergedOcc 0
17 mol 277 unq 0 iso 0 dist 8.90911 9.28545 12.1186 8.3109 6.66936 14.6021 numMergedOcc 0
18 mol 277 unq 1 iso 0 dist 8.90911 9.28545 12.1186 16.7779 8.15119 18.3977 numMergedOcc 0
19 mol 281 unq 0 iso 0 dist 5.0007 9.26654 5.96808 8.1531 6.58925 12.1214 numMergedOcc 0
20 mol 294 unq 0 iso 0 dist 9.00901 7.86196 12.6147 11.231 6.37998 13.3301 numMergedOcc 0
21 mol 294 unq 1 iso 0 dist 9.00901 7.86196 12.6147 14.1974 9.77023 11.7486 numMergedOcc 0
