0 mol 94 unq 0 iso 0 dist 6.31237 6.64613 7.39788 6.3708 8.13248 12.4073 numMergedOcc 0
1 mol 112 unq 0 iso 0 dist 8.86938 6.85365 12.8768 13.8988 9.13413 20.085 numMergedOcc 0
2 mol 113 unq 0 iso 0 dist 7.2443 8.94447 8.69934 12.6498 9.80191 7.77845 numMergedOcc 0
3 mol 120 unq 0 iso 0 dist 5.06555 9.68343 8.94259 12.8264 9.41521 17.318 numMergedOcc 0
4 mol 133 unq 0 iso 0 dist 9.00172 4.95674 9.53782 11.693 7.85025 8.91353 numMergedOcc 0
5 mol 134 unq 0 iso 0 dist 5.50687 5.98435 10.9715 5.84146 7.31419 8.72056 numMergedOcc 0
6 mol 134 unq 1 iso 0 dist 5.50687 8.80672 8.96357 5.84146 7.31419 12.9061 numMergedOcc 0
7 mol 148 unq 0 iso 0 dist 7.95671 8.274 5.29104 4.16381 9.64123 10.1716 numMergedOcc 0
8 mol 150 unq 0 iso 0 dist 8.12659 8.39743 5.45499 4.19097 9.72257 10.1 numMergedOcc 0
9 mol 197 unq 0 iso 0 dist 6.18446 6.58245 5.2908 7.6839 7.18765 9.47487 numMergedOcc 0
10 mol 197 unq 1 iso 0 dist 9.96544 6.58245 6.23998 7.6839 7.41091 9.47487 numMergedOcc 0
11 mol 206 unq 0 iso 0 dist 6.22964 8.65687 5.94313 7.72978 6.18991 11.2328 numMergedOcc 0
12 mol 206 unq 1 iso 0 dist 6.22964 8.65687 5.94313 6.21219 8.68547 12.9755 numMergedOcc 0
13 mol 218 unq 0 iso 0 dist 9.79816 7.89694 11.0503 6.61764 9.95084 13.9215 numMergedOcc 0
14 mol 218 unq 1 iso 0 dist 9.79816 5.66171 7.47048 6.61764 9.95084 10.2399 numMergedOcc 0
15 mol 233 unq 0 iso 0 dist 6.48196 7.99897 8.96098 5.36235 4.94074 11.259 numMergedOcc 0
16 mol 266 unq 0 iso 0 dist 6.95233 9.15288 4.27792 9.07546 8.82941 6.1432 numMergedOcc 0
17 mol 266 unq 1 iso 0 dist 6.95233 6.11795 11.5523 9.07546 8.82941 13.6654 numMergedOcc 0
18 mol 277 unq 0 iso 0 dist 9.38793 9.28545 17.5025 7.48053 5.37894 16.5306 numMergedOcc 0
