0 mol 15 unq 0 iso 0 dist 9.20338 11.6322 7.12903 14.2985 5.51916 6.82505 12.2224 8.96967 5.55659 9.78051 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 9.04865 12.4435 8.23643 16.8224 11.0832 7.20519 15.835 13.6944 5.5841 9.80108 numMergedOcc 0
2 mol 19 unq 1 iso 0 dist 9.04865 12.4435 8.23643 18.8997 12.3093 6.864 15.835 13.6944 5.5841 8.58657 numMergedOcc 0
3 mol 100 unq 0 iso 0 dist 9.82043 7.58985 7.75343 12.0248 15.209 7.47343 10.7848 16.0363 10.1589 8.72704 numMergedOcc 0
4 mol 127 unq 0 iso 0 dist 8.20636 16.0489 8.59981 22.1143 14.085 9.30299 13.4385 6.3244 4.77464 9.81878 numMergedOcc 0
5 mol 127 unq 1 iso 0 dist 8.03243 9.75166 8.59981 8.40046 14.085 9.30299 7.34983 6.3244 4.77464 9.81878 numMergedOcc 0
6 mol 155 unq 0 iso 0 dist 5.64806 6.68061 7.16254 9.70079 6.3845 6.23493 5.84938 6.51096 4.9093 9.17284 numMergedOcc 0
7 mol 155 unq 1 iso 0 dist 5.64806 11.0287 9.14392 9.70079 6.3845 7.46303 5.84938 6.51096 6.3437 9.17284 numMergedOcc 0
8 mol 155 unq 2 iso 0 dist 5.64806 11.0287 9.14392 15.6872 12.1814 6.43582 22.5472 18.2998 12.8482 9.38946 numMergedOcc 0
9 mol 155 unq 3 iso 0 dist 5.64806 11.0287 9.14392 15.6872 12.1814 6.43582 17.2345 13.2154 8.27726 7.36102 numMergedOcc 0
10 mol 156 unq 0 iso 0 dist 8.47477 6.39035 6.27641 12.8527 7.29758 7.44554 5.74389 6.90155 6.29785 9.36805 numMergedOcc 0
11 mol 156 unq 1 iso 0 dist 8.47477 6.39035 6.27641 11.0838 4.53931 9.83699 5.74389 6.90155 6.29785 7.55203 numMergedOcc 0
12 mol 156 unq 2 iso 0 dist 8.57453 9.27577 6.27641 13.6067 7.29758 7.44554 4.95416 6.90155 6.29785 9.36805 numMergedOcc 0
13 mol 156 unq 3 iso 0 dist 8.57453 9.27577 6.27641 9.16591 4.53931 9.83699 4.95416 6.90155 6.29785 7.55203 numMergedOcc 0
14 mol 175 unq 0 iso 0 dist 6.84347 12.1089 9.31887 17.1425 11.0415 9.0018 8.65486 4.79852 8.22779 9.8589 numMergedOcc 0
15 mol 175 unq 1 iso 0 dist 6.84347 12.1089 9.31887 11.1504 5.0384 7.652 8.65486 4.79852 8.22779 7.24908 numMergedOcc 0
16 mol 214 unq 0 iso 0 dist 6.35728 10.644 7.46831 8.49704 6.67959 8.85478 13.4309 11.7443 8.47007 6.97182 numMergedOcc 0
17 mol 214 unq 1 iso 0 dist 6.35728 10.644 7.46831 8.49704 6.67959 8.85478 13.5787 12.7646 12.8334 6.1175 numMergedOcc 0
18 mol 224 unq 0 iso 0 dist 6.4508 5.41021 6.67585 9.33771 5.29877 8.95269 11.498 9.47554 7.98696 6.87664 numMergedOcc 0
19 mol 224 unq 1 iso 0 dist 6.4508 4.91322 6.65984 9.33771 5.29877 6.57273 11.498 9.47554 7.12232 6.87664 numMergedOcc 0
20 mol 224 unq 2 iso 0 dist 8.60781 5.63485 6.87664 9.34636 7.98696 8.95269 5.46434 8.89778 9.36098 7.06793 numMergedOcc 0
21 mol 224 unq 3 iso 0 dist 8.60781 5.63485 6.87664 9.34636 7.98696 8.95269 5.03449 9.47554 5.29877 6.67585 numMergedOcc 0
22 mol 224 unq 4 iso 0 dist 8.60781 5.63485 6.87664 9.79616 7.12232 6.57273 5.03449 9.47554 5.29877 6.65984 numMergedOcc 0
23 mol 235 unq 0 iso 0 dist 8.60471 5.47633 9.58736 9.94654 9.66021 5.4638 8.18344 11.9287 4.65302 8.21247 numMergedOcc 0
24 mol 259 unq 0 iso 0 dist 5.70124 11.9055 6.77938 10.5558 4.99891 5.30224 16.8431 11.4462 5.31048 8.37865 numMergedOcc 0
25 mol 282 unq 0 iso 0 dist 5.2527 4.85461 6.85028 9.63346 6.3384 8.04483 14.5422 13.4504 10.1236 8.8673 numMergedOcc 0
26 mol 282 unq 1 iso 0 dist 5.2527 8.85797 7.32347 9.63346 6.3384 6.33524 14.5422 13.4504 7.36881 8.8673 numMergedOcc 0
