0 mol 92 unq 0 iso 0 dist 9.11791 3.91176 9.61144 13.2504 14.8146 9.36001 numMergedOcc 0
1 mol 92 unq 1 iso 0 dist 9.11791 6.02121 6.13521 11.8688 4.78289 7.06939 numMergedOcc 0
2 mol 95 unq 0 iso 0 dist 8.98691 5.9335 8.0675 6.5136 9.7565 9.3948 numMergedOcc 0
3 mol 98 unq 0 iso 0 dist 8.96016 4.54306 8.65429 10.5303 8.35877 9.64383 numMergedOcc 0
4 mol 98 unq 1 iso 0 dist 8.96016 4.54306 8.65429 11.233 9.9123 7.54889 numMergedOcc 0
5 mol 98 unq 2 iso 0 dist 8.96016 4.54306 8.65429 9.48388 8.49566 7.78931 numMergedOcc 0
6 mol 105 unq 0 iso 0 dist 9.44567 6.52143 9.84347 13.4986 8.40852 9.16718 numMergedOcc 0
7 mol 105 unq 1 iso 0 dist 9.44567 6.52143 9.84347 10.401 4.7574 7.94633 numMergedOcc 0
8 mol 117 unq 0 iso 0 dist 6.98104 7.44479 5.20001 10.7424 5.17524 6.10127 numMergedOcc 0
9 mol 129 unq 0 iso 0 dist 5.51129 3.82645 8.4375 6.1421 5.57978 6.69691 numMergedOcc 0
10 mol 129 unq 1 iso 0 dist 5.51129 5.75588 8.62413 6.1421 5.57978 5.51197 numMergedOcc 0
11 mol 129 unq 2 iso 0 dist 5.51129 4.18263 6.93102 6.1421 5.57978 8.86944 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 6.55143 6.82908 4.54218 11.5041 10.5394 8.07097 numMergedOcc 0
13 mol 141 unq 1 iso 0 dist 4.35548 6.82908 8.36316 11.5041 11.2797 8.07097 numMergedOcc 0
14 mol 141 unq 2 iso 0 dist 7.5024 10.0459 8.36316 11.6996 11.2797 8.07097 numMergedOcc 0
15 mol 213 unq 0 iso 0 dist 8.22702 6.86914 5.81317 12.9392 5.69131 7.94911 numMergedOcc 0
16 mol 222 unq 0 iso 0 dist 9.41577 16.4604 8.79662 21.7636 13.3218 7.48954 numMergedOcc 0
17 mol 241 unq 0 iso 0 dist 6.8951 5.9313 6.2767 12.8027 7.9304 7.95042 numMergedOcc 0
18 mol 241 unq 1 iso 0 dist 5.65753 4.61243 6.2767 5.40961 7.9304 7.95042 numMergedOcc 0
19 mol 241 unq 2 iso 0 dist 7.31224 6.31237 6.2767 5.57621 7.9304 7.95042 numMergedOcc 0
20 mol 264 unq 0 iso 0 dist 9.17189 10.0046 6.66615 12.5841 5.2836 5.90924 numMergedOcc 0
21 mol 264 unq 1 iso 0 dist 9.17189 10.0046 6.66615 10.8641 4.53426 5.90058 numMergedOcc 0
22 mol 264 unq 2 iso 0 dist 9.17189 10.0046 6.66615 17.3426 13.628 9.58916 numMergedOcc 0
23 mol 276 unq 0 iso 0 dist 9.37008 7.37489 8.53037 8.63281 6.23528 8.6759 numMergedOcc 0
