0 mol 24 unq 0 iso 0 dist 9.01567 8.91183 6.19899 8.92779 7.03544 3.53396 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 9.01567 8.91183 6.19899 9.76111 6.93597 5.95865 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 9.01567 13.0212 8.49709 8.92779 7.03544 10.8745 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 9.01567 13.0212 8.49709 9.76111 6.93597 3.33439 numMergedOcc 0
4 mol 24 unq 4 iso 0 dist 8.4051 10.1698 6.61696 6.7846 7.85986 9.24731 numMergedOcc 0
5 mol 24 unq 5 iso 0 dist 8.4051 10.1698 6.61696 8.03955 4.30252 3.53396 numMergedOcc 0
6 mol 24 unq 6 iso 0 dist 8.4051 13.6174 5.80953 6.7846 7.85986 11.1587 numMergedOcc 0
7 mol 24 unq 7 iso 0 dist 8.4051 13.6174 5.80953 8.03955 4.30252 8.72577 numMergedOcc 0
8 mol 24 unq 8 iso 0 dist 7.29868 8.91183 6.61696 13.7992 7.85986 9.24731 numMergedOcc 0
9 mol 24 unq 9 iso 0 dist 7.29868 8.91183 6.61696 8.92779 4.30252 3.53396 numMergedOcc 0
10 mol 24 unq 10 iso 0 dist 7.29868 5.69214 5.80953 13.7992 7.85986 11.1587 numMergedOcc 0
11 mol 24 unq 11 iso 0 dist 7.29868 5.69214 5.80953 8.92779 4.30252 8.72577 numMergedOcc 0
12 mol 24 unq 12 iso 0 dist 8.60554 14.8647 6.61696 13.2846 7.85986 9.24731 numMergedOcc 0
13 mol 24 unq 13 iso 0 dist 8.60554 14.8647 6.61696 12.3897 4.30252 3.53396 numMergedOcc 0
14 mol 24 unq 14 iso 0 dist 8.60554 5.11636 5.80953 13.2846 7.85986 11.1587 numMergedOcc 0
15 mol 24 unq 15 iso 0 dist 8.60554 5.11636 5.80953 12.3897 4.30252 8.72577 numMergedOcc 0
16 mol 58 unq 0 iso 0 dist 8.80614 11.3019 7.58739 4.59417 6.41008 8.98585 numMergedOcc 0
17 mol 58 unq 1 iso 0 dist 8.80614 9.87158 9.01564 4.59417 6.41008 10.5853 numMergedOcc 0
18 mol 58 unq 2 iso 0 dist 8.80614 5.86526 7.11065 4.59417 6.41008 5.11422 numMergedOcc 0
19 mol 61 unq 0 iso 0 dist 9.25641 8.89519 8.60069 9.57611 9.83914 8.57997 numMergedOcc 0
20 mol 85 unq 0 iso 0 dist 9.82915 11.9064 5.05893 11.9949 8.04853 3.65186 numMergedOcc 0
21 mol 85 unq 1 iso 0 dist 9.82915 11.9064 5.05893 13.3089 6.46549 5.41777 numMergedOcc 0
22 mol 85 unq 2 iso 0 dist 9.82915 14.7521 5.71866 11.9949 8.04853 7.00044 numMergedOcc 0
23 mol 85 unq 3 iso 0 dist 9.82915 14.7521 5.71866 13.3089 6.46549 5.85247 numMergedOcc 0
24 mol 91 unq 0 iso 0 dist 9.30539 12.6799 8.77355 4.73184 9.97813 9.60912 numMergedOcc 0
25 mol 113 unq 0 iso 0 dist 8.8822 13.9729 9.30645 15.3211 7.40338 9.59189 numMergedOcc 0
26 mol 135 unq 0 iso 0 dist 5.62052 8.50814 7.28318 3.78012 8.72359 12.1562 numMergedOcc 0
27 mol 135 unq 1 iso 0 dist 5.62052 8.50814 7.28318 10.9403 7.02963 5.83178 numMergedOcc 0
28 mol 135 unq 2 iso 0 dist 7.85645 3.95636 7.28318 9.62654 8.72359 12.1562 numMergedOcc 0
29 mol 135 unq 3 iso 0 dist 7.85645 3.95636 7.28318 8.06169 7.02963 5.83178 numMergedOcc 0
30 mol 141 unq 0 iso 0 dist 8.10291 4.32342 7.42144 8.76709 4.92382 5.83839 numMergedOcc 0
31 mol 141 unq 1 iso 0 dist 8.10291 7.17845 6.27658 8.76709 4.92382 3.7404 numMergedOcc 0
32 mol 141 unq 2 iso 0 dist 9.97343 13.4066 6.65731 6.45283 9.38036 14.5559 numMergedOcc 0
33 mol 141 unq 3 iso 0 dist 9.70413 8.54432 6.65731 11.3136 9.38036 14.5559 numMergedOcc 0
34 mol 184 unq 0 iso 0 dist 6.42735 4.08775 7.81263 5.03539 7.02762 3.74437 numMergedOcc 0
35 mol 188 unq 0 iso 0 dist 7.14503 9.71636 8.66624 8.02684 8.34477 3.42559 numMergedOcc 0
36 mol 194 unq 0 iso 0 dist 8.65535 10.0756 4.19371 12.8006 8.43182 9.23342 numMergedOcc 0
37 mol 194 unq 1 iso 0 dist 8.65535 16.4082 9.71015 12.8006 8.43182 11.7699 numMergedOcc 0
38 mol 232 unq 0 iso 0 dist 8.50102 9.74344 9.9183 6.95968 9.78273 3.43286 numMergedOcc 0
39 mol 232 unq 1 iso 0 dist 9.40808 5.10213 9.9183 4.04428 9.78273 3.43286 numMergedOcc 0
40 mol 235 unq 0 iso 0 dist 6.36341 13.089 7.39085 4.67058 7.26232 14.4239 numMergedOcc 0
41 mol 235 unq 1 iso 0 dist 6.21292 10.5354 7.39085 10.28 7.26232 14.4239 numMergedOcc 0
42 mol 235 unq 2 iso 0 dist 9.21736 11.3865 7.39085 13.783 7.26232 14.4239 numMergedOcc 0
43 mol 244 unq 0 iso 0 dist 5.50492 6.1597 6.53416 8.49798 9.30179 4.99117 numMergedOcc 0
44 mol 244 unq 1 iso 0 dist 5.50492 6.1597 6.53416 9.54706 6.10489 7.28456 numMergedOcc 0
45 mol 244 unq 2 iso 0 dist 5.50492 6.1597 6.53416 4.06591 4.4204 5.39452 numMergedOcc 0
46 mol 273 unq 0 iso 0 dist 8.83865 4.24707 7.85836 9.32873 9.81919 7.37764 numMergedOcc 0
47 mol 273 unq 1 iso 0 dist 8.83865 8.56043 6.35532 9.32873 9.81919 7.04946 numMergedOcc 0
48 mol 273 unq 2 iso 0 dist 9.18157 6.65672 7.85836 5.04315 9.81919 7.37764 numMergedOcc 0
49 mol 273 unq 3 iso 0 dist 9.18157 8.81454 6.35532 5.04315 9.81919 7.04946 numMergedOcc 0
50 mol 274 unq 0 iso 0 dist 8.52587 16.9539 8.60027 12.5154 8.09181 10.6981 numMergedOcc 0
51 mol 274 unq 1 iso 0 dist 6.39866 8.87855 8.60027 4.60007 8.09181 10.6981 numMergedOcc 0
52 mol 292 unq 0 iso 0 dist 9.88863 5.94 8.6233 9.81399 9.373 11.0273 numMergedOcc 0
