0 mol 54 unq 0 iso 0 dist 9.20429 12.9186 7.16132 9.24708 6.91496 9.41463 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 9.27389 5.18148 6.17207 13.8253 12.0839 9.63906 numMergedOcc 0
2 mol 68 unq 1 iso 0 dist 9.27389 5.18148 6.17207 11.4805 10.0156 7.71872 numMergedOcc 0
3 mol 68 unq 2 iso 0 dist 7.89424 3.89663 7.39665 11.9342 10.6721 8.19932 numMergedOcc 0
4 mol 68 unq 3 iso 0 dist 9.40333 12.6908 9.8703 13.9507 10.9724 8.19932 numMergedOcc 0
5 mol 69 unq 0 iso 0 dist 7.25721 3.77519 5.99857 9.74162 8.67853 9.08745 numMergedOcc 0
6 mol 110 unq 0 iso 0 dist 7.32156 5.2677 8.49678 10.6474 6.79448 9.25023 numMergedOcc 0
7 mol 162 unq 0 iso 0 dist 7.69229 6.69138 7.37333 11.5559 4.68369 8.91326 numMergedOcc 0
8 mol 162 unq 1 iso 0 dist 7.69229 6.82744 7.45998 11.5559 4.68369 8.33649 numMergedOcc 0
9 mol 205 unq 0 iso 0 dist 8.52924 10.3649 6.52816 10.8414 6.49049 4.97301 numMergedOcc 0
10 mol 222 unq 0 iso 0 dist 6.77368 4.54951 6.74196 9.99638 5.17002 9.79673 numMergedOcc 0
11 mol 222 unq 1 iso 0 dist 6.77368 4.54951 6.74196 9.9582 6.70898 6.39673 numMergedOcc 0
12 mol 222 unq 2 iso 0 dist 6.77368 10.5815 8.36842 9.9582 6.70898 7.80676 numMergedOcc 0
13 mol 222 unq 3 iso 0 dist 7.73634 11.1253 6.74196 11.75 5.17002 9.79673 numMergedOcc 0
14 mol 222 unq 4 iso 0 dist 7.73634 11.1253 6.74196 9.69145 6.70898 6.39673 numMergedOcc 0
15 mol 222 unq 5 iso 0 dist 7.73634 5.10026 8.36842 9.69145 6.70898 7.80676 numMergedOcc 0
16 mol 264 unq 0 iso 0 dist 8.91251 4.77242 5.90058 12.1277 3.35448 8.55386 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 7.7743 5.06236 7.45616 5.55176 3.65199 4.93516 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 7.7743 5.06236 7.45616 5.55176 3.65199 4.93516 numMergedOcc 0
19 mol 289 unq 0 iso 0 dist 7.7743 5.06236 7.45616 5.55176 3.65199 4.93516 numMergedOcc 0
