0 mol 28 unq 0 iso 0 dist 5.21094 5.07861 7.66985 10.5835 10.6532 8.51428 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 5.21094 6.20494 9.17482 10.5835 10.6532 9.28621 numMergedOcc 0
2 mol 28 unq 2 iso 0 dist 5.21094 6.20494 9.17482 13.0886 12.471 8.94643 numMergedOcc 0
3 mol 28 unq 3 iso 0 dist 5.21094 6.20494 9.17482 13.8056 16.1107 8.36195 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 8.64844 10.7132 9.31883 6.70369 11.2712 8.73053 numMergedOcc 0
5 mol 34 unq 1 iso 0 dist 8.64844 10.7132 9.31883 8.49278 9.1555 7.07087 numMergedOcc 0
6 mol 43 unq 0 iso 0 dist 9.32155 14.0484 9.82307 18.3894 11.8732 6.57978 numMergedOcc 0
7 mol 54 unq 0 iso 0 dist 8.30888 6.10172 5.85153 11.9663 14.6974 9.24708 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 9.26179 11.7078 8.59337 12.722 9.94048 7.9575 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 9.26179 11.7078 8.59337 8.50028 6.88106 5.88827 numMergedOcc 0
10 mol 73 unq 2 iso 0 dist 9.26179 16.0942 7.66942 8.50028 6.88106 9.66175 numMergedOcc 0
11 mol 143 unq 0 iso 0 dist 7.52352 10.7652 5.66207 10.8089 7.78035 6.38786 numMergedOcc 0
12 mol 143 unq 1 iso 0 dist 7.23619 7.81193 5.66207 12.4482 7.78035 6.38786 numMergedOcc 0
13 mol 159 unq 0 iso 0 dist 9.81782 4.86107 8.12238 9.5915 4.92046 8.61788 numMergedOcc 0
14 mol 182 unq 0 iso 0 dist 7.60057 9.03379 9.19506 11.4357 5.69505 8.7486 numMergedOcc 0
15 mol 182 unq 1 iso 0 dist 7.60057 9.03379 9.19506 14.4027 8.61027 9.06707 numMergedOcc 0
16 mol 188 unq 0 iso 0 dist 7.98533 5.20357 6.18257 7.82113 4.94877 7.50005 numMergedOcc 0
17 mol 230 unq 0 iso 0 dist 9.03723 5.25305 5.63025 10.1518 4.32828 5.48736 numMergedOcc 0
18 mol 232 unq 0 iso 0 dist 9.3946 3.83464 6.19029 8.64213 5.08257 5.86945 numMergedOcc 0
