0 mol 8 unq 0 iso 0 dist 8.33604 8.53529 11.4716 4.85329 6.26865 11.4415 12.4076 17.5554 7.03958 15.4959 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 8.33604 8.53529 11.4716 4.85329 6.26865 11.4415 8.4069 13.3876 7.18019 12.9498 numMergedOcc 0
2 mol 8 unq 2 iso 0 dist 8.33604 8.53529 11.4716 4.85329 6.26865 11.4415 12.9016 18.4127 8.44009 17.4051 numMergedOcc 0
3 mol 15 unq 0 iso 0 dist 8.21493 7.07399 6.33828 5.01321 8.96967 10.7313 11.0528 10.6943 5.89412 15.4996 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 8.63333 9.92355 12.0055 10.6476 6.96494 17.9037 5.30792 11.5023 5.93884 15.4158 numMergedOcc 0
5 mol 58 unq 1 iso 0 dist 8.63333 9.92355 12.0055 10.6476 6.96494 17.9037 5.35073 8.89374 7.68678 12.7331 numMergedOcc 0
6 mol 58 unq 2 iso 0 dist 8.63333 9.92355 12.0055 5.92889 7.01363 13.7654 5.30792 11.5023 5.93884 10.2241 numMergedOcc 0
7 mol 58 unq 3 iso 0 dist 8.63333 9.92355 12.0055 5.92889 7.01363 13.7654 5.35073 8.89374 7.68678 7.05413 numMergedOcc 0
8 mol 58 unq 4 iso 0 dist 8.89374 7.68678 12.0055 12.7331 6.96494 17.9037 5.35073 8.63333 9.92355 10.6476 numMergedOcc 0
9 mol 58 unq 5 iso 0 dist 8.89374 7.68678 12.0055 12.7331 6.96494 17.9037 4.81926 11.5023 5.93884 15.4158 numMergedOcc 0
10 mol 58 unq 6 iso 0 dist 8.89374 7.68678 12.0055 7.05413 7.01363 13.7654 5.35073 8.63333 9.92355 5.92889 numMergedOcc 0
11 mol 58 unq 7 iso 0 dist 8.89374 7.68678 12.0055 7.05413 7.01363 13.7654 4.81926 11.5023 5.93884 10.2241 numMergedOcc 0
12 mol 155 unq 0 iso 0 dist 9.87281 8.69157 7.6506 5.48883 6.51096 9.0529 7.01918 12.0728 6.53347 9.36596 numMergedOcc 0
13 mol 155 unq 1 iso 0 dist 7.39644 6.53347 6.40403 5.40375 7.37901 7.55196 7.01918 13.1369 8.69157 8.78665 numMergedOcc 0
14 mol 155 unq 2 iso 0 dist 8.27111 8.69157 6.00473 5.48883 8.73171 9.0529 7.01918 10.6403 6.53347 9.36596 numMergedOcc 0
15 mol 156 unq 0 iso 0 dist 8.47155 6.30021 10.0003 9.30783 6.90155 13.7525 5.76755 9.36805 9.47433 7.29758 numMergedOcc 0
16 mol 156 unq 1 iso 0 dist 9.36805 9.44367 10.143 7.29758 6.90155 5.81122 5.56175 13.1853 7.90267 8.67156 numMergedOcc 0
17 mol 156 unq 2 iso 0 dist 9.36805 9.47433 10.0003 7.29758 6.90155 13.7525 5.76755 8.47155 6.30021 9.30783 numMergedOcc 0
18 mol 213 unq 0 iso 0 dist 9.59129 7.73322 9.93085 12.2579 8.74171 9.1514 5.45334 13.8919 8.14332 13.2686 numMergedOcc 0
19 mol 232 unq 0 iso 0 dist 7.07392 8.50102 10.9886 6.66754 9.86861 15.1077 6.56633 11.5589 9.40808 9.69932 numMergedOcc 0
20 mol 235 unq 0 iso 0 dist 5.65339 6.21292 7.96337 6.43692 7.27958 12.1942 8.31875 10.4621 6.36341 12.1802 numMergedOcc 0
21 mol 235 unq 1 iso 0 dist 5.65339 6.21292 7.96337 6.43692 7.27958 12.1942 4.53064 9.96742 9.21736 7.82697 numMergedOcc 0
22 mol 235 unq 2 iso 0 dist 5.65339 6.95126 4.29892 6.43692 7.27958 7.95766 9.89669 10.7117 9.55668 4.65302 numMergedOcc 0
23 mol 238 unq 0 iso 0 dist 9.90142 7.57812 10.3147 15.7973 8.70193 18.5467 10.0191 10.7386 9.24557 15.5674 numMergedOcc 0
24 mol 238 unq 1 iso 0 dist 8.14172 7.02333 4.38002 5.68826 6.00721 7.04753 5.6348 10.6978 8.94014 10.8635 numMergedOcc 0
25 mol 238 unq 2 iso 0 dist 8.14172 7.02333 4.38002 5.68826 6.00721 7.04753 5.31152 6.77463 8.67864 4.87097 numMergedOcc 0
26 mol 238 unq 3 iso 0 dist 6.77463 8.67864 4.38002 4.87097 6.00721 7.04753 8.87326 10.6978 8.94014 10.8635 numMergedOcc 0
27 mol 238 unq 4 iso 0 dist 6.77463 8.67864 4.38002 4.87097 6.00721 7.04753 5.31152 8.14172 7.02333 5.68826 numMergedOcc 0
28 mol 274 unq 0 iso 0 dist 9.19234 9.45514 12.625 14.168 8.49866 12.6896 10.501 14.4703 7.46394 17.8575 numMergedOcc 0
29 mol 274 unq 1 iso 0 dist 9.19234 9.45514 12.625 14.168 8.49866 12.6896 11.7196 17.725 8.91672 16.804 numMergedOcc 0
30 mol 274 unq 2 iso 0 dist 9.19234 9.45514 12.625 14.168 8.49866 12.6896 6.828 14.3124 7.1729 17.7203 numMergedOcc 0
31 mol 274 unq 3 iso 0 dist 9.19234 6.39866 4.60275 14.168 8.49866 11.838 11.3308 12.5979 8.52587 19.9909 numMergedOcc 0
