0 mol 7 unq 0 iso 0 dist 7.38748 16.4559 9.5325 12.483 6.26213 4.47024 numMergedOcc 0
1 mol 10 unq 0 iso 0 dist 8.2106 5.05805 6.6345 9.44938 4.82016 7.26523 numMergedOcc 0
2 mol 33 unq 0 iso 0 dist 8.37901 6.24385 8.7979 7.99091 7.07421 5.2746 numMergedOcc 0
3 mol 69 unq 0 iso 0 dist 7.03224 8.63814 8.77132 11.4022 6.99469 7.17934 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 7.57394 5.8099 6.25529 12.0083 7.86188 6.96576 numMergedOcc 0
5 mol 85 unq 1 iso 0 dist 7.57394 10.3439 9.74248 12.0083 7.86188 9.55766 numMergedOcc 0
6 mol 103 unq 0 iso 0 dist 6.79959 7.19464 9.06479 12.352 8.17578 9.7695 numMergedOcc 0
7 mol 103 unq 1 iso 0 dist 6.79959 5.23889 9.90038 5.24823 6.4251 9.39702 numMergedOcc 0
8 mol 109 unq 0 iso 0 dist 8.53914 5.02505 8.71813 12.8311 8.55838 9.08671 numMergedOcc 0
9 mol 176 unq 0 iso 0 dist 7.98755 10.9549 7.89418 14.4453 14.4249 8.27428 numMergedOcc 0
10 mol 195 unq 0 iso 0 dist 5.61326 9.48981 7.92844 10.0267 5.44336 5.46768 numMergedOcc 0
11 mol 210 unq 0 iso 0 dist 8.05949 13.0196 5.6524 17.1927 12.1997 9.05206 numMergedOcc 0
12 mol 214 unq 0 iso 0 dist 4.36421 4.08418 5.96047 12.8841 14.0805 8.91471 numMergedOcc 0
13 mol 220 unq 0 iso 0 dist 6.39087 8.88074 7.4083 12.2225 10.8016 9.3439 numMergedOcc 0
14 mol 220 unq 1 iso 0 dist 9.86144 7.46247 7.4083 15.0484 10.8016 9.3439 numMergedOcc 0
15 mol 220 unq 2 iso 0 dist 8.57174 7.92534 8.19109 8.37469 6.77956 5.47295 numMergedOcc 0
16 mol 220 unq 3 iso 0 dist 6.80214 14.2789 8.19109 13.4196 6.77956 5.47295 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 8.26312 14.2074 7.07461 13.8386 7.94 8.29649 numMergedOcc 0
18 mol 239 unq 1 iso 0 dist 7.58554 10.871 7.07461 15.0943 7.94 8.29649 numMergedOcc 0
19 mol 268 unq 0 iso 0 dist 5.94741 7.50067 9.7571 10.2129 6.83253 8.28346 numMergedOcc 0
20 mol 290 unq 0 iso 0 dist 7.79492 9.6129 9.90135 14.9468 10.7335 9.45004 numMergedOcc 0
