0 mol 45 unq 0 iso 0 dist 6.94727 8.81519 4.51883 7.18002 6.76899 9.51166 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 8.95084 9.07969 14.1077 9.54119 16.8103 4.91531 numMergedOcc 0
2 mol 48 unq 1 iso 0 dist 8.95084 9.07969 14.1077 7.87476 5.194 11.0434 numMergedOcc 0
3 mol 48 unq 2 iso 0 dist 8.95084 9.61448 15.9997 9.54119 16.8103 4.38297 numMergedOcc 0
4 mol 48 unq 3 iso 0 dist 8.95084 9.61448 15.9997 7.87476 5.194 12.4168 numMergedOcc 0
5 mol 48 unq 4 iso 0 dist 9.18584 8.94842 14.0934 9.77004 17.3505 5.22869 numMergedOcc 0
6 mol 48 unq 5 iso 0 dist 9.18584 8.94842 14.0934 8.36323 5.19123 11.1154 numMergedOcc 0
7 mol 48 unq 6 iso 0 dist 9.18584 9.9555 16.3517 9.77004 17.3505 4.48872 numMergedOcc 0
8 mol 48 unq 7 iso 0 dist 9.18584 9.9555 16.3517 8.36323 5.19123 12.8399 numMergedOcc 0
9 mol 90 unq 0 iso 0 dist 9.05357 8.48639 9.90294 5.28331 6.46537 5.4118 numMergedOcc 0
10 mol 211 unq 0 iso 0 dist 9.21889 6.69877 8.35742 8.54189 5.76615 4.83618 numMergedOcc 0
11 mol 232 unq 0 iso 0 dist 9.00007 9.11418 14.5281 9.69133 12.899 3.43286 numMergedOcc 0
12 mol 234 unq 0 iso 0 dist 8.79054 9.432 9.3336 8.33309 6.12476 4.64981 numMergedOcc 0
13 mol 239 unq 0 iso 0 dist 9.12618 8.9327 4.4484 7.01673 6.48266 3.13463 numMergedOcc 0
14 mol 257 unq 0 iso 0 dist 9.46934 5.81865 10.0311 9.95749 9.58945 5.65819 numMergedOcc 0
15 mol 257 unq 1 iso 0 dist 9.48415 5.81865 5.65031 9.95749 4.02482 5.65819 numMergedOcc 0
16 mol 260 unq 0 iso 0 dist 7.469 7.4261 12.7207 8.43724 5.91135 9.98348 numMergedOcc 0
17 mol 260 unq 1 iso 0 dist 5.9721 7.4261 3.83954 8.43724 9.38032 9.98348 numMergedOcc 0
18 mol 273 unq 0 iso 0 dist 8.41674 9.45329 10.9311 8.5948 9.83412 7.04946 numMergedOcc 0
19 mol 277 unq 0 iso 0 dist 6.73204 8.18813 12.2659 9.48076 6.50127 17.1919 numMergedOcc 0
20 mol 287 unq 0 iso 0 dist 5.55753 9.9229 6.79087 7.81225 7.45064 5.55422 numMergedOcc 0
21 mol 288 unq 0 iso 0 dist 5.55753 9.9229 6.79087 7.81225 7.45064 5.55422 numMergedOcc 0
22 mol 289 unq 0 iso 0 dist 5.55753 9.9229 6.79087 7.81225 7.45064 5.55422 numMergedOcc 0
