0 mol 76 unq 0 iso 0 dist 9.02702 4.66377 5.83882 8.26803 15.6591 9.86664 numMergedOcc 0
1 mol 92 unq 0 iso 0 dist 9.86635 5.22996 8.42036 7.25403 14.8183 7.0561 numMergedOcc 0
2 mol 115 unq 0 iso 0 dist 9.86701 8.99731 5.15368 6.3642 12.2183 8.4965 numMergedOcc 0
3 mol 119 unq 0 iso 0 dist 7.94271 8.84146 8.70712 15.9454 11.9763 9.6121 numMergedOcc 0
4 mol 119 unq 1 iso 0 dist 7.94271 8.84146 8.70712 17.7274 17.932 9.57341 numMergedOcc 0
5 mol 119 unq 2 iso 0 dist 9.89093 8.84146 6.89245 15.9454 6.88175 9.6121 numMergedOcc 0
6 mol 119 unq 3 iso 0 dist 9.89093 8.84146 6.89245 17.7274 14.8889 9.57341 numMergedOcc 0
7 mol 128 unq 0 iso 0 dist 8.38644 7.50206 13.8715 9.41812 17.1875 9.12084 numMergedOcc 0
8 mol 130 unq 0 iso 0 dist 7.77423 4.85559 7.14836 7.12852 13.1141 6.5739 numMergedOcc 0
9 mol 173 unq 0 iso 0 dist 6.03275 4.0037 5.5911 9.37239 8.64838 7.17037 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 6.20806 5.67811 5.26443 9.71205 6.80944 8.17226 numMergedOcc 0
11 mol 222 unq 0 iso 0 dist 6.19798 9.04499 7.26742 12.9462 11.2674 7.97027 numMergedOcc 0
12 mol 222 unq 1 iso 0 dist 6.19798 9.04499 7.26742 11.0561 12.7466 6.81955 numMergedOcc 0
13 mol 222 unq 2 iso 0 dist 6.19798 9.04499 7.26742 9.50604 10.656 4.9876 numMergedOcc 0
14 mol 239 unq 0 iso 0 dist 9.50474 8.83751 17.347 3.28983 11.7858 6.43209 numMergedOcc 0
15 mol 239 unq 1 iso 0 dist 9.50474 8.77688 14.2492 3.28983 11.7858 8.48769 numMergedOcc 0
16 mol 250 unq 0 iso 0 dist 9.19468 5.43238 5.35596 5.17779 11.8802 6.93875 numMergedOcc 0
17 mol 278 unq 0 iso 0 dist 9.70353 8.04138 12.325 13.9445 20.2022 8.63072 numMergedOcc 0
18 mol 278 unq 1 iso 0 dist 9.70353 8.04138 12.325 13.0506 16.8764 7.59696 numMergedOcc 0
19 mol 284 unq 0 iso 0 dist 6.81709 5.68818 11.5658 14.1802 19.9348 9.07503 numMergedOcc 0
20 mol 284 unq 1 iso 0 dist 6.81709 5.68818 11.5658 11.9492 16.6802 7.63256 numMergedOcc 0
