0 mol 119 unq 0 iso 0 dist 8.64438 8.24549 10.9345 4.99061 9.85387 6.49205 6.85677 5.81718 5.19198 6.18601 numMergedOcc 0
1 mol 133 unq 0 iso 0 dist 7.4963 7.96689 7.52391 11.9436 9.89098 9.48243 15.7632 8.96845 11.6637 9.91388 numMergedOcc 0
2 mol 133 unq 1 iso 0 dist 7.74278 7.96689 7.72261 11.9436 12.3165 9.48243 15.7632 18.5054 11.6637 9.91388 numMergedOcc 0
3 mol 133 unq 2 iso 0 dist 7.74278 9.07294 13.4864 13.1243 14.6141 8.84018 15.4604 16.8088 8.00493 6.5107 numMergedOcc 0
4 mol 133 unq 3 iso 0 dist 8.54607 9.6582 7.72261 16.3678 12.3165 9.48243 19.1009 18.5054 11.6637 9.91388 numMergedOcc 0
5 mol 133 unq 4 iso 0 dist 8.54607 9.07294 16.2835 13.1243 16.6279 8.84018 15.4604 20.2351 8.00493 6.5107 numMergedOcc 0
6 mol 133 unq 5 iso 0 dist 8.08807 7.96689 13.0543 11.9436 11.5517 9.48243 15.7632 19.3263 11.6637 9.91388 numMergedOcc 0
7 mol 152 unq 0 iso 0 dist 6.26222 6.4737 7.54583 7.20811 9.35916 9.74498 13.03 11.7248 10.7816 8.67331 numMergedOcc 0
8 mol 152 unq 1 iso 0 dist 6.26222 6.4737 7.54583 7.20811 9.35916 9.74498 9.36082 6.4987 7.26476 8.05741 numMergedOcc 0
9 mol 175 unq 0 iso 0 dist 9.30469 6.21546 10.7476 5.73338 9.09725 8.69888 12.3723 16.8008 11.5099 9.0018 numMergedOcc 0
10 mol 175 unq 1 iso 0 dist 9.30469 6.21546 10.7476 5.73338 9.09725 8.69888 6.73365 12.0877 5.50014 5.6234 numMergedOcc 0
11 mol 175 unq 2 iso 0 dist 9.30469 6.21546 10.7476 5.73338 9.09725 8.69888 9.45659 9.79219 7.39186 6.57069 numMergedOcc 0
12 mol 175 unq 3 iso 0 dist 9.30469 6.03184 4.81365 5.73338 9.09725 5.08206 12.3723 16.8008 12.1783 9.0018 numMergedOcc 0
13 mol 175 unq 4 iso 0 dist 9.30469 6.03184 4.81365 5.73338 9.09725 5.08206 6.73365 12.0877 7.28617 5.6234 numMergedOcc 0
14 mol 175 unq 5 iso 0 dist 9.30469 6.03184 4.81365 5.73338 9.09725 5.08206 9.45659 9.79219 5.77256 6.57069 numMergedOcc 0
15 mol 181 unq 0 iso 0 dist 9.72342 8.78709 6.36904 9.49952 10.6801 6.00053 16.4033 13.5947 11.1879 8.03334 numMergedOcc 0
16 mol 182 unq 0 iso 0 dist 8.22267 8.94671 4.39505 4.85077 9.36307 7.86625 12.503 9.72559 5.40949 9.31746 numMergedOcc 0
17 mol 210 unq 0 iso 0 dist 7.52542 6.24111 6.24537 13.3929 11.965 9.67457 8.07523 6.36047 5.82028 6.18308 numMergedOcc 0
18 mol 210 unq 1 iso 0 dist 9.58979 9.00343 6.24537 12.3088 11.965 9.67457 7.56882 6.36047 5.82028 6.18308 numMergedOcc 0
19 mol 220 unq 0 iso 0 dist 8.37469 7.86207 15.7127 10.6943 18.2396 9.8711 8.9077 16.7786 4.90657 9.23153 numMergedOcc 0
20 mol 224 unq 0 iso 0 dist 9.31156 7.62593 12.0777 11.4653 12.2287 9.33771 4.79841 6.87755 5.41021 8.95269 numMergedOcc 0
21 mol 224 unq 1 iso 0 dist 9.31156 7.62593 12.0777 11.4653 12.2287 9.33771 9.04374 9.28732 4.91322 6.57273 numMergedOcc 0
22 mol 224 unq 2 iso 0 dist 9.31156 7.62593 12.0777 11.4653 12.2287 9.33771 15.1903 11.9963 12.979 5.78342 numMergedOcc 0
23 mol 224 unq 3 iso 0 dist 9.31156 7.62593 12.0777 12.5358 15.1247 7.39839 14.7665 15.6382 7.65225 6.65832 numMergedOcc 0
24 mol 224 unq 4 iso 0 dist 9.31156 7.62593 12.0777 12.5358 15.1247 7.39839 9.04374 9.28732 4.91322 6.60589 numMergedOcc 0
25 mol 224 unq 5 iso 0 dist 9.31156 7.62593 12.0777 12.5358 15.1247 7.39839 15.1903 11.9963 12.979 9.16166 numMergedOcc 0
26 mol 224 unq 6 iso 0 dist 9.31156 7.58998 5.66462 6.87755 4.79841 6.23882 12.2287 11.4653 15.0038 8.95269 numMergedOcc 0
27 mol 259 unq 0 iso 0 dist 8.06955 4.55368 9.68677 6.18571 11.1172 7.93997 13.6279 17.4129 14.8465 7.46176 numMergedOcc 0
28 mol 282 unq 0 iso 0 dist 9.06244 7.93511 10.499 9.67023 12.9555 5.67266 14.1723 11.5782 9.63727 8.04483 numMergedOcc 0
29 mol 282 unq 1 iso 0 dist 9.06244 7.93511 10.499 9.67023 12.9555 5.67266 6.84554 6.17747 4.58403 8.76532 numMergedOcc 0
30 mol 282 unq 2 iso 0 dist 9.06244 7.93511 10.499 9.67023 12.9555 5.67266 9.51581 7.94567 5.04235 6.33524 numMergedOcc 0
