0 mol 15 unq 0 iso 0 dist 4.27439 4.20187 7.70482 7.38118 5.68079 9.04489 numMergedOcc 0
1 mol 17 unq 0 iso 0 dist 7.9118 4.79124 7.30541 4.12287 8.55161 5.22923 numMergedOcc 0
2 mol 53 unq 0 iso 0 dist 7.65728 7.44001 9.26043 7.09591 9.52717 5.86778 numMergedOcc 0
3 mol 59 unq 0 iso 0 dist 9.6702 4.29599 7.35217 9.27313 7.89643 7.17002 numMergedOcc 0
4 mol 59 unq 1 iso 0 dist 8.21972 10.1298 7.35217 7.78337 7.89643 7.17002 numMergedOcc 0
5 mol 61 unq 0 iso 0 dist 8.18795 5.99169 9.12873 4.10723 7.93498 3.30756 numMergedOcc 0
6 mol 62 unq 0 iso 0 dist 6.31934 10.8763 8.73923 5.12034 7.61377 11.09 numMergedOcc 0
7 mol 63 unq 0 iso 0 dist 9.1747 10.4918 8.17492 11.8271 6.89855 6.63195 numMergedOcc 0
8 mol 88 unq 0 iso 0 dist 9.75856 8.05534 8.54948 7.19267 5.6516 9.17488 numMergedOcc 0
9 mol 91 unq 0 iso 0 dist 5.22576 8.32183 8.01351 10.358 8.91998 9.46631 numMergedOcc 0
10 mol 91 unq 1 iso 0 dist 8.65409 15.2435 8.01351 15.2668 8.91998 9.46631 numMergedOcc 0
11 mol 93 unq 0 iso 0 dist 7.65028 4.54745 6.67776 7.0652 5.23929 3.27874 numMergedOcc 0
12 mol 129 unq 0 iso 0 dist 9.83241 8.17961 7.28273 9.45041 4.4077 3.50174 numMergedOcc 0
13 mol 129 unq 1 iso 0 dist 9.83241 8.17961 7.28273 5.50122 8.4874 3.98945 numMergedOcc 0
14 mol 224 unq 0 iso 0 dist 9.02319 9.54987 9.99396 8.71755 6.06793 4.10466 numMergedOcc 0
15 mol 252 unq 0 iso 0 dist 9.63094 9.61801 7.50015 12.4587 8.99666 3.94102 numMergedOcc 0
16 mol 252 unq 1 iso 0 dist 9.63094 4.96787 8.33933 12.4587 8.99666 7.98948 numMergedOcc 0
17 mol 252 unq 2 iso 0 dist 9.63094 4.32578 5.95029 12.4587 8.99666 11.4978 numMergedOcc 0
18 mol 266 unq 0 iso 0 dist 5.59641 4.00824 8.08479 8.51059 7.36137 9.42852 numMergedOcc 0
19 mol 266 unq 1 iso 0 dist 5.59641 4.00824 8.08479 7.79913 4.95415 9.63536 numMergedOcc 0
