0 mol 48 unq 0 iso 0 dist 8.31952 4.99432 6.42242 9.7516 5.84184 9.53081 numMergedOcc 0
1 mol 67 unq 0 iso 0 dist 7.98453 10.7913 6.07108 14.2197 6.56501 6.12267 numMergedOcc 0
2 mol 67 unq 1 iso 0 dist 7.98453 10.7913 6.07108 16.4353 12.2002 8.43162 numMergedOcc 0
3 mol 67 unq 2 iso 0 dist 7.98453 10.3712 5.63802 14.2197 6.56501 8.27009 numMergedOcc 0
4 mol 67 unq 3 iso 0 dist 7.98453 10.3712 5.63802 10.0617 4.53519 5.80736 numMergedOcc 0
5 mol 91 unq 0 iso 0 dist 7.42828 10.1359 6.93893 11.0308 5.06999 8.91354 numMergedOcc 0
6 mol 91 unq 1 iso 0 dist 5.98441 11.3866 6.93893 9.34369 5.06999 8.91354 numMergedOcc 0
7 mol 91 unq 2 iso 0 dist 5.45873 9.36488 6.93893 10.3161 5.06999 8.91354 numMergedOcc 0
8 mol 109 unq 0 iso 0 dist 8.82036 9.91621 9.13614 5.56645 6.12935 8.53914 numMergedOcc 0
9 mol 147 unq 0 iso 0 dist 6.6094 12.352 8.40219 9.89646 5.30729 5.32865 numMergedOcc 0
10 mol 147 unq 1 iso 0 dist 9.70579 12.3045 8.40219 13.308 5.30729 5.32865 numMergedOcc 0
11 mol 147 unq 2 iso 0 dist 8.514 10.4422 8.40219 9.9332 5.30729 5.32865 numMergedOcc 0
12 mol 230 unq 0 iso 0 dist 9.3968 10.6631 9.07808 12.163 4.32112 9.14989 numMergedOcc 0
13 mol 236 unq 0 iso 0 dist 7.87572 8.73194 7.13854 7.61854 9.7977 7.74348 numMergedOcc 0
14 mol 239 unq 0 iso 0 dist 9.26512 4.95913 6.91534 12.8564 9.08479 8.48545 numMergedOcc 0
15 mol 244 unq 0 iso 0 dist 9.28249 14.9665 9.97458 20.7639 16.3 7.43391 numMergedOcc 0
16 mol 244 unq 1 iso 0 dist 9.28249 14.9665 9.97458 10.7691 4.89551 7.79787 numMergedOcc 0
17 mol 252 unq 0 iso 0 dist 9.41595 5.3246 7.60896 11.9364 4.35762 8.19645 numMergedOcc 0
18 mol 256 unq 0 iso 0 dist 8.73597 17.3254 9.65136 17.2226 9.83915 6.45473 numMergedOcc 0
19 mol 256 unq 1 iso 0 dist 7.32198 14.7962 9.65136 16.2478 9.83915 6.45473 numMergedOcc 0
20 mol 266 unq 0 iso 0 dist 5.62193 5.26607 9.54381 13.0079 14.5123 8.8646 numMergedOcc 0
21 mol 271 unq 0 iso 0 dist 6.70662 8.33152 7.03848 10.5057 11.0964 9.50884 numMergedOcc 0
