0 mol 48 unq 0 iso 0 dist 9.99971 5.9344 9.61448 10.7798 8.4772 7.78475 numMergedOcc 0
1 mol 55 unq 0 iso 0 dist 9.79757 13.1927 9.98226 10.4372 2.81599 9.88559 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 6.72469 6.38389 5.88256 6.27321 7.71726 6.34966 numMergedOcc 0
3 mol 85 unq 0 iso 0 dist 9.08834 10.6717 6.2454 15.7768 10.8586 5.79841 numMergedOcc 0
4 mol 206 unq 0 iso 0 dist 9.36144 8.09615 5.83021 13.2258 5.70985 6.69623 numMergedOcc 0
5 mol 206 unq 1 iso 0 dist 9.36144 15.0906 9.18711 13.2258 5.70985 6.21951 numMergedOcc 0
6 mol 214 unq 0 iso 0 dist 5.56977 5.26468 5.79617 6.90717 3.91276 7.43301 numMergedOcc 0
7 mol 217 unq 0 iso 0 dist 8.28155 6.7582 5.27487 12.8775 9.33845 9.37899 numMergedOcc 0
8 mol 217 unq 1 iso 0 dist 8.28155 6.7582 5.27487 5.88992 9.98266 6.14304 numMergedOcc 0
9 mol 243 unq 0 iso 0 dist 5.46817 9.12778 7.89993 11.8651 7.64155 5.98438 numMergedOcc 0
10 mol 247 unq 0 iso 0 dist 8.85175 16.3149 7.95874 21.9836 14.8141 9.9667 numMergedOcc 0
11 mol 260 unq 0 iso 0 dist 8.19223 4.96171 7.4261 10.7724 12.9257 9.56846 numMergedOcc 0
12 mol 277 unq 0 iso 0 dist 9.22453 7.09461 8.18813 6.71956 6.64795 5.92532 numMergedOcc 0
13 mol 279 unq 0 iso 0 dist 9.88022 11.71 5.60922 10.5467 3.70525 6.12347 numMergedOcc 0
14 mol 279 unq 1 iso 0 dist 9.88022 11.71 5.60922 11.1415 5.61412 8.79637 numMergedOcc 0
15 mol 279 unq 2 iso 0 dist 9.88198 5.86409 5.8845 5.02385 9.85432 8.16582 numMergedOcc 0
16 mol 285 unq 0 iso 0 dist 7.12723 11.2362 6.5354 14.8395 8.85284 8.35007 numMergedOcc 0
17 mol 285 unq 1 iso 0 dist 7.12723 11.2362 6.5354 13.1011 6.3633 8.02964 numMergedOcc 0
