0 mol 18 unq 0 iso 0 dist 7.23594 6.05493 9.1397 11.7722 8.70343 8.09187 numMergedOcc 0
1 mol 78 unq 0 iso 0 dist 7.80757 13.7086 7.91148 8.16546 4.92509 7.03887 numMergedOcc 0
2 mol 78 unq 1 iso 0 dist 7.80757 10.9209 6.59794 8.16546 4.92509 5.36451 numMergedOcc 0
3 mol 78 unq 2 iso 0 dist 7.80757 15.7494 8.34957 8.16546 4.92509 9.28354 numMergedOcc 0
4 mol 78 unq 3 iso 0 dist 9.2835 12.7015 7.91148 13.9157 4.92509 7.03887 numMergedOcc 0
5 mol 78 unq 4 iso 0 dist 9.2835 12.9102 6.59794 13.9157 4.92509 5.36451 numMergedOcc 0
6 mol 78 unq 5 iso 0 dist 9.2835 10.2933 8.34957 13.9157 4.92509 9.28354 numMergedOcc 0
7 mol 78 unq 6 iso 0 dist 5.02591 11.1086 7.91148 9.94668 4.92509 7.03887 numMergedOcc 0
8 mol 78 unq 7 iso 0 dist 5.02591 10.2834 6.59794 9.94668 4.92509 5.36451 numMergedOcc 0
9 mol 78 unq 8 iso 0 dist 5.02591 10.0935 8.34957 9.94668 4.92509 9.28354 numMergedOcc 0
10 mol 114 unq 0 iso 0 dist 5.87387 10.4408 9.93438 9.91452 9.2907 9.26486 numMergedOcc 0
11 mol 114 unq 1 iso 0 dist 5.87387 10.4408 9.93438 12.5269 8.88748 7.93956 numMergedOcc 0
12 mol 123 unq 0 iso 0 dist 8.87148 8.75597 8.111 16.9489 12.8359 8.53618 numMergedOcc 0
13 mol 123 unq 1 iso 0 dist 9.26057 6.36283 8.111 13.3869 12.8359 8.53618 numMergedOcc 0
14 mol 127 unq 0 iso 0 dist 9.79448 10.4591 5.39356 10.4933 4.77464 7.79077 numMergedOcc 0
15 mol 141 unq 0 iso 0 dist 4.93035 6.0008 7.46621 9.82638 7.57216 6.40751 numMergedOcc 0
16 mol 143 unq 0 iso 0 dist 8.72463 10.7652 8.99891 4.86894 5.44503 8.08798 numMergedOcc 0
17 mol 197 unq 0 iso 0 dist 6.22696 7.21941 9.23086 9.49122 5.2908 9.77656 numMergedOcc 0
18 mol 197 unq 1 iso 0 dist 8.12158 7.21941 8.37086 9.49122 10.5397 9.77656 numMergedOcc 0
19 mol 218 unq 0 iso 0 dist 5.52981 6.50485 6.09255 8.39955 4.54272 9.39609 numMergedOcc 0
20 mol 283 unq 0 iso 0 dist 7.92491 5.91899 9.07995 6.87568 6.86733 9.06774 numMergedOcc 0
