0 mol 9 unq 0 iso 0 dist 5.99711 11.6375 6.6347 5.79505 9.3523 12.1434 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.70141 9.42167 4.87192 12.1061 4.90592 3.4435 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 8.70141 9.42167 4.87192 6.81998 8.16324 7.63657 numMergedOcc 0
3 mol 30 unq 0 iso 0 dist 5.64067 10.8957 9.29609 7.27795 6.55815 14.3828 numMergedOcc 0
4 mol 30 unq 1 iso 0 dist 5.64067 10.8957 9.29609 7.22038 7.09121 9.27784 numMergedOcc 0
5 mol 68 unq 0 iso 0 dist 5.74389 5.52356 5.44028 6.32283 6.40693 7.25845 numMergedOcc 0
6 mol 120 unq 0 iso 0 dist 9.27951 13.2271 9.23243 6.71699 6.03352 6.93115 numMergedOcc 0
7 mol 158 unq 0 iso 0 dist 6.92225 5.9424 9.38045 4.31531 6.76055 9.44283 numMergedOcc 0
8 mol 158 unq 1 iso 0 dist 6.92225 5.9424 9.38045 9.29425 9.36343 10.8632 numMergedOcc 0
9 mol 162 unq 0 iso 0 dist 8.48559 10.7014 6.00293 7.15755 7.14263 8.06906 numMergedOcc 0
10 mol 162 unq 1 iso 0 dist 8.48559 10.7014 6.00293 7.74683 8.57005 6.76865 numMergedOcc 0
11 mol 163 unq 0 iso 0 dist 8.12896 6.31211 7.38157 10.595 7.8639 9.15824 numMergedOcc 0
12 mol 163 unq 1 iso 0 dist 8.88092 4.09836 7.38157 7.26899 7.8639 9.15824 numMergedOcc 0
13 mol 175 unq 0 iso 0 dist 9.08628 15.459 6.59925 9.7676 8.05247 11.3868 numMergedOcc 0
14 mol 175 unq 1 iso 0 dist 9.08628 15.459 6.59925 11.4159 9.71028 11.3992 numMergedOcc 0
15 mol 175 unq 2 iso 0 dist 8.35581 12.0623 6.59925 5.81984 8.05247 11.3868 numMergedOcc 0
16 mol 175 unq 3 iso 0 dist 8.35581 12.0623 6.59925 12.3602 9.71028 11.3992 numMergedOcc 0
17 mol 175 unq 4 iso 0 dist 6.72569 9.05904 6.59925 3.98834 8.05247 11.3868 numMergedOcc 0
18 mol 175 unq 5 iso 0 dist 6.72569 9.05904 6.59925 9.4225 9.71028 11.3992 numMergedOcc 0
19 mol 182 unq 0 iso 0 dist 9.52012 13.63 9.04642 7.42937 8.43933 8.4504 numMergedOcc 0
20 mol 194 unq 0 iso 0 dist 7.47107 9.86028 7.39369 10.7677 5.68348 8.10654 numMergedOcc 0
21 mol 225 unq 0 iso 0 dist 8.28454 16.1823 9.18343 14.1101 9.23935 6.88681 numMergedOcc 0
22 mol 225 unq 1 iso 0 dist 8.28454 16.1823 9.18343 12.969 7.77552 4.55231 numMergedOcc 0
23 mol 258 unq 0 iso 0 dist 8.78354 4.41915 8.65191 4.17741 9.91199 6.08477 numMergedOcc 0
