0 mol 0 unq 0 iso 0 dist 9.42137 7.65884 9.23213 8.60656 7.40865 9.30151 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 9.42137 12.7756 8.81979 8.60656 7.40865 6.11501 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 7.46102 4.81384 8.33604 10.4489 8.53529 11.4716 numMergedOcc 0
3 mol 11 unq 0 iso 0 dist 5.7435 11.1513 9.53002 4.08268 4.30695 11.9464 numMergedOcc 0
4 mol 11 unq 1 iso 0 dist 5.7435 11.1513 9.53002 4.24301 6.35398 7.5901 numMergedOcc 0
5 mol 43 unq 0 iso 0 dist 8.38387 6.35048 9.83618 7.13085 8.95682 4.54282 numMergedOcc 0
6 mol 54 unq 0 iso 0 dist 5.97635 8.98505 5.02241 11.5332 7.21717 11.0681 numMergedOcc 0
7 mol 58 unq 0 iso 0 dist 6.36193 6.05206 9.64665 4.37642 5.93884 5.27642 numMergedOcc 0
8 mol 58 unq 1 iso 0 dist 4.88613 9.80755 8.89374 4.37642 7.68678 12.0055 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 8.06168 4.65267 7.13087 4.53047 6.02816 6.93907 numMergedOcc 0
10 mol 73 unq 1 iso 0 dist 8.67532 13.4661 7.13087 7.05537 6.02816 6.93907 numMergedOcc 0
11 mol 109 unq 0 iso 0 dist 8.3164 5.49138 5.87358 4.81814 7.80523 6.89298 numMergedOcc 0
12 mol 131 unq 0 iso 0 dist 7.81337 6.25099 6.91348 4.34786 8.70296 9.93183 numMergedOcc 0
13 mol 131 unq 1 iso 0 dist 7.81337 6.25099 6.91348 11.6607 9.25558 5.90177 numMergedOcc 0
14 mol 131 unq 2 iso 0 dist 7.81337 14.8295 9.51418 4.34786 8.70296 16.5048 numMergedOcc 0
15 mol 131 unq 3 iso 0 dist 7.81337 14.8295 9.51418 11.6607 9.25558 5.70899 numMergedOcc 0
16 mol 155 unq 0 iso 0 dist 4.44292 4.40049 7.39644 5.45915 6.53347 6.40403 numMergedOcc 0
17 mol 155 unq 1 iso 0 dist 4.44292 6.61119 7.70572 5.45915 6.53347 4.40321 numMergedOcc 0
18 mol 176 unq 0 iso 0 dist 7.30954 4.20839 8.61331 13.8868 7.33273 13.7844 numMergedOcc 0
19 mol 181 unq 0 iso 0 dist 9.84952 11.14 7.98142 6.78739 5.94469 8.93991 numMergedOcc 0
20 mol 181 unq 1 iso 0 dist 9.84952 10.9006 7.37327 6.78739 5.94469 5.35588 numMergedOcc 0
21 mol 205 unq 0 iso 0 dist 5.96555 12.5517 9.19704 3.99238 6.03688 14.6029 numMergedOcc 0
22 mol 218 unq 0 iso 0 dist 8.5119 9.20149 7.18041 4.87337 6.1951 6.16211 numMergedOcc 0
23 mol 218 unq 1 iso 0 dist 8.5119 11.711 7.17547 4.87337 6.1951 7.21048 numMergedOcc 0
24 mol 222 unq 0 iso 0 dist 9.55777 5.78005 6.82208 12.979 7.67576 7.39748 numMergedOcc 0
25 mol 222 unq 1 iso 0 dist 9.55777 5.78005 6.82208 4.05539 9.82371 5.08928 numMergedOcc 0
26 mol 232 unq 0 iso 0 dist 7.70279 6.17401 7.07392 6.36084 8.50102 10.9886 numMergedOcc 0
27 mol 234 unq 0 iso 0 dist 7.46434 4.21173 6.16063 6.06471 6.30154 5.70413 numMergedOcc 0
28 mol 234 unq 1 iso 0 dist 7.46434 4.21173 6.16063 11.1213 7.32499 7.17691 numMergedOcc 0
29 mol 234 unq 2 iso 0 dist 7.50424 13.0543 6.16063 11.2248 6.30154 5.70413 numMergedOcc 0
30 mol 234 unq 3 iso 0 dist 7.50424 13.0543 6.16063 10.6488 7.32499 7.17691 numMergedOcc 0
31 mol 235 unq 0 iso 0 dist 9.11256 14.9183 9.58736 3.93066 9.55668 13.128 numMergedOcc 0
32 mol 235 unq 1 iso 0 dist 7.08539 4.28284 9.58736 13.0408 9.55668 13.128 numMergedOcc 0
33 mol 238 unq 0 iso 0 dist 9.32451 4.81145 6.05141 16.2294 8.94014 11.5793 numMergedOcc 0
34 mol 249 unq 0 iso 0 dist 6.37672 10.4294 8.83735 4.20164 5.48118 10.639 numMergedOcc 0
35 mol 249 unq 1 iso 0 dist 8.94023 9.10124 8.83735 5.93404 5.48118 10.639 numMergedOcc 0
36 mol 264 unq 0 iso 0 dist 8.43858 12.5468 9.0012 4.29482 7.16853 9.76317 numMergedOcc 0
37 mol 264 unq 1 iso 0 dist 8.43858 15.8008 9.5784 4.29482 7.16853 13.9064 numMergedOcc 0
38 mol 274 unq 0 iso 0 dist 6.55855 5.95459 9.19234 6.70266 9.45514 12.625 numMergedOcc 0
39 mol 274 unq 1 iso 0 dist 6.55855 5.95459 9.19234 5.15747 6.39866 4.60275 numMergedOcc 0
40 mol 292 unq 0 iso 0 dist 9.6898 13.2729 9.454 7.31058 7.83341 6.93991 numMergedOcc 0
41 mol 292 unq 1 iso 0 dist 5.75596 6.58789 9.454 8.07013 7.83341 6.93991 numMergedOcc 0
