0 mol 17 unq 0 iso 0 dist 6.89863 7.02884 11.5928 7.57677 14.0886 5.16502 numMergedOcc 0
1 mol 17 unq 1 iso 0 dist 6.89863 7.02884 11.5928 4.43871 10.6012 8.26398 numMergedOcc 0
2 mol 27 unq 0 iso 0 dist 7.57797 6.75307 5.60515 7.34574 5.27118 9.29273 numMergedOcc 0
3 mol 27 unq 1 iso 0 dist 6.94532 6.75307 5.84177 7.34574 8.16102 9.29273 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 6.50287 5.0478 7.67964 8.69776 9.12204 5.27979 numMergedOcc 0
5 mol 83 unq 0 iso 0 dist 6.83169 6.07433 11.4378 7.20975 6.72584 8.99451 numMergedOcc 0
6 mol 83 unq 1 iso 0 dist 8.92911 7.01146 11.4378 7.44689 6.72584 8.99451 numMergedOcc 0
7 mol 103 unq 0 iso 0 dist 5.09936 6.87901 9.41836 5.99213 7.85115 5.51053 numMergedOcc 0
8 mol 123 unq 0 iso 0 dist 8.75242 9.89206 6.03683 8.00307 12.6961 9.42762 numMergedOcc 0
9 mol 123 unq 1 iso 0 dist 8.75242 9.89206 6.03683 8.96416 10.1093 7.30244 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 8.43061 9.45931 15.6036 8.07317 16.2822 8.40695 numMergedOcc 0
11 mol 141 unq 1 iso 0 dist 8.43061 9.45931 15.6036 5.69432 13.7636 9.35867 numMergedOcc 0
12 mol 141 unq 2 iso 0 dist 8.43061 6.35397 9.62363 5.69432 13.7636 9.38036 numMergedOcc 0
13 mol 249 unq 0 iso 0 dist 9.87896 9.68308 5.74889 11.6107 6.32658 8.76518 numMergedOcc 0
14 mol 284 unq 0 iso 0 dist 9.40824 5.61727 10.747 3.39008 12.1526 7.74874 numMergedOcc 0
15 mol 284 unq 1 iso 0 dist 6.1324 5.61727 7.95816 3.39008 9.35991 7.74874 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 7.39418 8.82948 12.4113 6.23875 10.1135 7.99204 numMergedOcc 0
17 mol 288 unq 0 iso 0 dist 7.39418 8.82948 12.4113 6.23875 10.1135 7.99204 numMergedOcc 0
18 mol 289 unq 0 iso 0 dist 7.39418 8.82948 12.4113 6.23875 10.1135 7.99204 numMergedOcc 0
