0 mol 4 unq 0 iso 0 dist 6.12485 9.04027 9.77707 6.21697 6.86951 14.3341 numMergedOcc 0
1 mol 33 unq 0 iso 0 dist 7.44828 8.04019 14.7604 9.9897 8.74487 17.6314 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 7.36738 7.79266 4.7203 6.96922 8.98021 11.7921 numMergedOcc 0
3 mol 55 unq 0 iso 0 dist 5.24742 9.24055 5.25318 7.02539 9.29433 9.66898 numMergedOcc 0
4 mol 55 unq 1 iso 0 dist 9.29433 9.66898 5.25318 7.02539 5.24742 9.24055 numMergedOcc 0
5 mol 55 unq 2 iso 0 dist 9.24055 5.24742 5.25318 7.02539 9.66898 9.29433 numMergedOcc 0
6 mol 55 unq 3 iso 0 dist 9.66898 9.29433 5.25318 7.02539 9.24055 5.24742 numMergedOcc 0
7 mol 64 unq 0 iso 0 dist 8.52643 9.75299 4.78627 5.76037 5.41357 9.30042 numMergedOcc 0
8 mol 64 unq 1 iso 0 dist 5.41357 9.30042 4.78627 5.76037 8.52643 9.75299 numMergedOcc 0
9 mol 64 unq 2 iso 0 dist 9.75299 8.52643 4.78627 5.76037 9.30042 5.41357 numMergedOcc 0
10 mol 64 unq 3 iso 0 dist 9.30042 5.41357 4.78627 5.76037 9.75299 8.52643 numMergedOcc 0
11 mol 67 unq 0 iso 0 dist 6.04303 7.51967 4.29326 5.55985 6.12267 9.79696 numMergedOcc 0
12 mol 67 unq 1 iso 0 dist 6.04303 7.51967 4.29326 10.6111 8.27009 10.7873 numMergedOcc 0
13 mol 67 unq 2 iso 0 dist 6.04303 7.15248 9.42543 5.55985 6.12267 8.43162 numMergedOcc 0
14 mol 67 unq 3 iso 0 dist 6.04303 7.15248 9.42543 10.6111 8.27009 15.0981 numMergedOcc 0
15 mol 67 unq 4 iso 0 dist 6.12267 8.43162 9.42543 5.55985 6.04303 7.15248 numMergedOcc 0
16 mol 67 unq 5 iso 0 dist 6.12267 8.43162 9.42543 6.9953 8.27009 15.0981 numMergedOcc 0
17 mol 67 unq 6 iso 0 dist 8.27009 5.80736 8.61446 10.6111 6.04303 13.472 numMergedOcc 0
18 mol 67 unq 7 iso 0 dist 8.27009 5.80736 8.61446 6.9953 6.12267 9.90205 numMergedOcc 0
19 mol 67 unq 8 iso 0 dist 7.15248 7.51967 11.9277 5.55985 8.43162 9.79696 numMergedOcc 0
20 mol 67 unq 9 iso 0 dist 7.15248 6.04303 9.42543 5.55985 8.43162 6.12267 numMergedOcc 0
21 mol 67 unq 10 iso 0 dist 8.43162 6.12267 9.42543 5.55985 7.15248 6.04303 numMergedOcc 0
22 mol 73 unq 0 iso 0 dist 8.07498 7.46419 4.84196 11.7643 9.47045 8.68218 numMergedOcc 0
23 mol 73 unq 1 iso 0 dist 8.07498 7.18693 6.75212 11.7643 9.47045 12.9833 numMergedOcc 0
24 mol 73 unq 2 iso 0 dist 7.46419 8.07498 4.84196 11.7643 8.68218 9.47045 numMergedOcc 0
25 mol 73 unq 3 iso 0 dist 7.46419 7.18693 4.44291 11.7643 8.68218 12.9833 numMergedOcc 0
26 mol 73 unq 4 iso 0 dist 9.47045 7.48556 8.96403 11.7643 8.07498 14.7134 numMergedOcc 0
27 mol 73 unq 5 iso 0 dist 9.47045 8.68218 4.84196 11.7643 8.07498 7.46419 numMergedOcc 0
28 mol 73 unq 6 iso 0 dist 8.68218 7.48556 7.99821 11.7643 7.46419 14.7134 numMergedOcc 0
29 mol 73 unq 7 iso 0 dist 8.68218 9.47045 4.84196 11.7643 7.46419 8.07498 numMergedOcc 0
30 mol 87 unq 0 iso 0 dist 9.90256 5.63748 10.445 6.69898 7.57471 11.1249 numMergedOcc 0
31 mol 87 unq 1 iso 0 dist 5.63748 9.90256 10.445 5.38943 5.62336 14.3873 numMergedOcc 0
32 mol 103 unq 0 iso 0 dist 8.078 6.56481 11.6637 6.73664 7.66418 13.1619 numMergedOcc 0
33 mol 115 unq 0 iso 0 dist 9.67606 8.80824 6.10898 5.54133 9.41083 11.8022 numMergedOcc 0
34 mol 140 unq 0 iso 0 dist 7.77669 9.67726 4.18932 11.1772 8.94921 11.8878 numMergedOcc 0
35 mol 140 unq 1 iso 0 dist 7.60956 9.9171 5.17212 8.73614 9.13339 11.3016 numMergedOcc 0
36 mol 189 unq 0 iso 0 dist 7.54658 6.77641 6.4062 8.91303 9.95686 14.0544 numMergedOcc 0
37 mol 189 unq 1 iso 0 dist 9.95686 9.47321 10.4321 8.91303 7.54658 14.5375 numMergedOcc 0
38 mol 189 unq 2 iso 0 dist 9.47321 9.95686 10.4321 8.74557 6.38294 13.9052 numMergedOcc 0
39 mol 204 unq 0 iso 0 dist 6.20044 8.41232 6.2357 8.63339 6.62514 12.3365 numMergedOcc 0
40 mol 204 unq 1 iso 0 dist 6.20044 8.41232 6.2357 11.09 9.41996 15.3934 numMergedOcc 0
41 mol 214 unq 0 iso 0 dist 5.86911 7.89258 5.68826 8.94237 7.82201 12.9008 numMergedOcc 0
42 mol 220 unq 0 iso 0 dist 8.57174 9.89039 15.5559 12.1405 6.80214 18.0464 numMergedOcc 0
43 mol 224 unq 0 iso 0 dist 7.31608 7.96226 5.19836 5.92863 6.23677 10.0534 numMergedOcc 0
44 mol 224 unq 1 iso 0 dist 7.31608 7.96226 5.19836 5.57847 9.04741 11.9839 numMergedOcc 0
45 mol 224 unq 2 iso 0 dist 7.96226 7.31608 5.19836 10.9623 8.82663 10.6574 numMergedOcc 0
46 mol 243 unq 0 iso 0 dist 8.78924 4.64178 4.56434 10.9243 7.70472 9.16988 numMergedOcc 0
47 mol 243 unq 1 iso 0 dist 7.70472 9.16988 4.56434 10.9243 8.78924 4.64178 numMergedOcc 0
48 mol 243 unq 2 iso 0 dist 4.64178 8.78924 4.56434 10.9243 9.16988 7.70472 numMergedOcc 0
49 mol 243 unq 3 iso 0 dist 9.16988 7.70472 4.56434 10.9243 4.64178 8.78924 numMergedOcc 0
50 mol 245 unq 0 iso 0 dist 7.95061 9.96585 14.3262 15.2703 9.5096 22.6305 numMergedOcc 0
51 mol 245 unq 1 iso 0 dist 7.95061 7.27022 9.67137 15.2703 9.5096 18.6442 numMergedOcc 0
52 mol 245 unq 2 iso 0 dist 9.5096 8.0848 7.00614 15.2703 7.95061 13.7347 numMergedOcc 0
53 mol 258 unq 0 iso 0 dist 7.25618 8.10903 5.31174 7.64421 8.70193 11.866 numMergedOcc 0
54 mol 261 unq 0 iso 0 dist 6.0437 7.58385 5.29945 4.70691 4.85199 9.25991 numMergedOcc 0
55 mol 261 unq 1 iso 0 dist 6.0437 7.58385 5.29945 9.51335 9.13604 12.7905 numMergedOcc 0
56 mol 261 unq 2 iso 0 dist 4.85199 9.72159 10.4196 4.70691 6.0437 13.9529 numMergedOcc 0
57 mol 261 unq 3 iso 0 dist 4.85199 9.72159 10.4196 6.43452 9.13604 6.89731 numMergedOcc 0
58 mol 261 unq 4 iso 0 dist 9.13604 6.89731 10.4196 9.51335 6.0437 13.9529 numMergedOcc 0
59 mol 261 unq 5 iso 0 dist 9.13604 6.89731 10.4196 6.43452 4.85199 9.72159 numMergedOcc 0
60 mol 261 unq 6 iso 0 dist 9.13604 9.85607 10.8346 9.51335 6.0437 15.4656 numMergedOcc 0
61 mol 261 unq 7 iso 0 dist 9.13604 9.85607 10.8346 6.43452 4.85199 12.3279 numMergedOcc 0
62 mol 261 unq 8 iso 0 dist 9.72159 4.85199 10.4196 6.43452 6.89731 9.13604 numMergedOcc 0
63 mol 261 unq 9 iso 0 dist 6.89731 9.13604 10.4196 6.43452 9.72159 4.85199 numMergedOcc 0
64 mol 261 unq 10 iso 0 dist 6.89731 9.85607 5.65316 6.43452 9.72159 12.3279 numMergedOcc 0
65 mol 266 unq 0 iso 0 dist 6.57444 7.9555 5.77131 13.1611 9.39714 10.1316 numMergedOcc 0
66 mol 266 unq 1 iso 0 dist 7.9555 6.57444 5.77131 6.70676 8.8646 11.4453 numMergedOcc 0
67 mol 282 unq 0 iso 0 dist 6.04225 8.54984 5.72971 4.79603 5.00258 10.1355 numMergedOcc 0
68 mol 282 unq 1 iso 0 dist 6.04225 8.54984 5.72971 9.24679 8.22117 12.5071 numMergedOcc 0
69 mol 282 unq 2 iso 0 dist 5.00258 9.98886 10.6828 4.79603 6.04225 14.3467 numMergedOcc 0
70 mol 282 unq 3 iso 0 dist 5.00258 9.98886 10.6828 5.92133 8.22117 6.81887 numMergedOcc 0
71 mol 282 unq 4 iso 0 dist 8.22117 6.81887 10.6828 9.24679 6.04225 14.3467 numMergedOcc 0
72 mol 282 unq 5 iso 0 dist 8.22117 6.81887 10.6828 5.92133 5.00258 9.98886 numMergedOcc 0
73 mol 282 unq 6 iso 0 dist 9.98886 5.00258 10.6828 5.92133 6.81887 8.22117 numMergedOcc 0
74 mol 282 unq 7 iso 0 dist 6.81887 8.22117 10.6828 5.92133 9.98886 5.00258 numMergedOcc 0
