0 mol 24 unq 0 iso 0 dist 6.35095 6.80952 4.93188 14.7006 13.5399 9.65174 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 5.87895 9.6739 9.24958 17.7716 15.0923 9.65174 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 9.89021 16.3451 8.03303 9.85386 6.28792 8.59337 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 9.89021 16.3451 8.03303 14.0925 4.4893 7.66942 numMergedOcc 0
4 mol 109 unq 0 iso 0 dist 7.4371 5.02505 8.67766 11.4588 10.8085 9.67274 numMergedOcc 0
5 mol 112 unq 0 iso 0 dist 8.35164 5.51584 6.78038 9.64908 6.35793 9.34689 numMergedOcc 0
6 mol 112 unq 1 iso 0 dist 9.43616 5.51584 6.47042 9.64908 4.69658 9.34689 numMergedOcc 0
7 mol 114 unq 0 iso 0 dist 8.19156 12.0204 9.7918 8.53631 4.97363 6.4569 numMergedOcc 0
8 mol 143 unq 0 iso 0 dist 7.5984 11.1239 8.41611 5.33772 6.75249 7.22 numMergedOcc 0
9 mol 162 unq 0 iso 0 dist 9.89142 7.6506 6.20182 9.88912 4.51281 9.56342 numMergedOcc 0
10 mol 163 unq 0 iso 0 dist 6.56115 11.7732 8.38738 9.69093 4.2768 9.40912 numMergedOcc 0
11 mol 188 unq 0 iso 0 dist 7.95028 9.91112 8.57261 13.4944 8.02684 6.18257 numMergedOcc 0
12 mol 230 unq 0 iso 0 dist 8.56954 6.46721 9.09271 14.0634 12.9537 7.83105 numMergedOcc 0
13 mol 230 unq 1 iso 0 dist 8.56954 6.46721 9.09271 9.81678 12.3005 5.63025 numMergedOcc 0
14 mol 230 unq 2 iso 0 dist 9.23938 6.46721 7.44838 14.0634 10.9745 7.83105 numMergedOcc 0
15 mol 230 unq 3 iso 0 dist 9.23938 6.46721 7.44838 9.81678 8.05169 5.63025 numMergedOcc 0
16 mol 230 unq 4 iso 0 dist 8.33847 5.02022 6.41286 8.01593 10.043 6.31092 numMergedOcc 0
17 mol 230 unq 5 iso 0 dist 9.12305 9.81615 6.41286 12.7606 10.043 6.31092 numMergedOcc 0
18 mol 253 unq 0 iso 0 dist 8.53729 4.60689 7.77998 10.6968 14.6881 9.86765 numMergedOcc 0
19 mol 253 unq 1 iso 0 dist 8.53729 4.60689 7.77998 6.93942 9.46115 6.3738 numMergedOcc 0
20 mol 253 unq 2 iso 0 dist 8.07341 9.18036 7.77998 13.8658 14.6881 9.86765 numMergedOcc 0
21 mol 253 unq 3 iso 0 dist 8.07341 9.18036 7.77998 9.31626 9.46115 6.3738 numMergedOcc 0
