0 mol 4 unq 0 iso 0 dist 8.60134 4.54643 5.51567 13.2248 5.46803 9.61247 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 8.75465 5.8785 8.36111 11.9194 5.07985 8.94874 numMergedOcc 0
2 mol 7 unq 1 iso 0 dist 8.00249 5.8785 5.99898 11.9194 6.83196 8.94874 numMergedOcc 0
3 mol 72 unq 0 iso 0 dist 9.20886 5.50284 5.49421 5.88647 8.89293 8.71615 numMergedOcc 0
4 mol 102 unq 0 iso 0 dist 9.16431 5.89461 8.24949 8.63253 7.85919 9.61113 numMergedOcc 0
5 mol 102 unq 1 iso 0 dist 9.16431 5.89461 8.24949 5.15752 5.05224 7.59973 numMergedOcc 0
6 mol 117 unq 0 iso 0 dist 7.85205 11.3792 8.54233 10.5587 6.66127 5.24519 numMergedOcc 0
7 mol 173 unq 0 iso 0 dist 8.46046 6.54119 8.51691 11.4988 10.1842 9.17063 numMergedOcc 0
8 mol 173 unq 1 iso 0 dist 8.46046 6.54119 8.51691 11.8831 7.24163 9.99332 numMergedOcc 0
9 mol 173 unq 2 iso 0 dist 8.46046 6.54119 8.51691 8.68723 5.48443 7.13369 numMergedOcc 0
10 mol 184 unq 0 iso 0 dist 8.09403 9.23342 9.07247 13.4563 10.6375 5.13722 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 9.00537 13.8548 7.12029 16.5976 8.06464 8.40343 numMergedOcc 0
12 mol 186 unq 1 iso 0 dist 8.9388 12.2795 7.12029 15.5239 8.06464 8.40343 numMergedOcc 0
13 mol 193 unq 0 iso 0 dist 5.06367 10.0502 8.28942 10.1719 9.98298 9.16852 numMergedOcc 0
14 mol 207 unq 0 iso 0 dist 7.25953 11.2345 8.01415 9.91546 4.43093 4.55528 numMergedOcc 0
15 mol 207 unq 1 iso 0 dist 9.05688 11.2345 8.25861 9.91546 5.15938 4.55528 numMergedOcc 0
16 mol 239 unq 0 iso 0 dist 9.77592 10.3403 6.0567 12.3493 3.80345 8.01565 numMergedOcc 0
17 mol 260 unq 0 iso 0 dist 6.79386 5.14726 9.68232 4.1077 6.37501 9.05149 numMergedOcc 0
18 mol 260 unq 1 iso 0 dist 6.19564 5.14726 8.29663 4.1077 7.50166 9.05149 numMergedOcc 0
19 mol 274 unq 0 iso 0 dist 9.61255 5.67354 9.40401 12.9362 13.3483 9.30966 numMergedOcc 0
20 mol 274 unq 1 iso 0 dist 9.61255 5.67354 9.40401 8.88613 7.5856 5.38704 numMergedOcc 0
21 mol 274 unq 2 iso 0 dist 9.61255 5.67354 9.40401 11.0731 5.04738 8.05503 numMergedOcc 0
22 mol 274 unq 3 iso 0 dist 9.61255 7.47139 5.64169 8.88613 7.5856 8.26695 numMergedOcc 0
23 mol 274 unq 4 iso 0 dist 9.61255 7.47139 5.64169 11.0731 5.04738 5.59151 numMergedOcc 0
24 mol 274 unq 5 iso 0 dist 9.61255 7.47139 5.64169 12.803 12.0951 8.17922 numMergedOcc 0
25 mol 284 unq 0 iso 0 dist 7.62783 10.3394 9.02411 13.1733 7.00626 8.38071 numMergedOcc 0
26 mol 284 unq 1 iso 0 dist 7.62783 10.3394 9.02411 12.5746 6.34668 7.80784 numMergedOcc 0
