0 mol 64 unq 0 iso 0 dist 9.5663 12.0987 5.66803 17.7741 10.0913 7.77991 numMergedOcc 0
1 mol 64 unq 1 iso 0 dist 9.5663 12.0987 5.66803 11.6368 5.68492 5.1488 numMergedOcc 0
2 mol 87 unq 0 iso 0 dist 6.62798 10.7803 9.90256 13.4901 7.62644 9.53368 numMergedOcc 0
3 mol 87 unq 1 iso 0 dist 6.62798 10.7803 9.90256 14.0019 10.8096 6.54532 numMergedOcc 0
4 mol 87 unq 2 iso 0 dist 9.94718 13.2349 9.90256 12.9428 7.62644 9.53368 numMergedOcc 0
5 mol 87 unq 3 iso 0 dist 9.94718 13.2349 9.90256 17.5693 10.8096 6.54532 numMergedOcc 0
6 mol 114 unq 0 iso 0 dist 6.79014 5.41029 6.54778 9.92286 5.84883 6.06039 numMergedOcc 0
7 mol 114 unq 1 iso 0 dist 6.79014 5.41029 6.54778 14.4214 10.9953 9.36502 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 7.47105 11.193 9.2759 12.4415 8.01541 8.03691 numMergedOcc 0
9 mol 147 unq 0 iso 0 dist 6.85063 5.38327 5.32865 14.9819 10.7118 9.80032 numMergedOcc 0
10 mol 148 unq 0 iso 0 dist 6.4413 9.68187 9.18753 11.7541 6.16168 9.21934 numMergedOcc 0
11 mol 150 unq 0 iso 0 dist 6.62609 9.76535 9.15244 11.9152 6.14967 9.13113 numMergedOcc 0
12 mol 188 unq 0 iso 0 dist 6.07498 6.28041 8.1907 10.7079 9.12244 6.02957 numMergedOcc 0
13 mol 195 unq 0 iso 0 dist 8.3941 8.14211 5.61326 8.64561 7.60926 9.40031 numMergedOcc 0
14 mol 204 unq 0 iso 0 dist 9.32133 9.09362 6.62514 15.367 10.239 6.35305 numMergedOcc 0
15 mol 204 unq 1 iso 0 dist 6.58174 10.9794 6.20044 9.01666 5.64245 6.35305 numMergedOcc 0
16 mol 204 unq 2 iso 0 dist 6.58174 9.00243 8.41232 9.01666 5.64245 9.23348 numMergedOcc 0
17 mol 250 unq 0 iso 0 dist 9.79531 9.85962 7.89067 18.1064 11.0863 9.45903 numMergedOcc 0
18 mol 250 unq 1 iso 0 dist 9.79531 9.85962 7.89067 15.5759 9.98799 8.51531 numMergedOcc 0
19 mol 266 unq 0 iso 0 dist 7.72433 5.86368 6.57444 11.9698 5.53503 9.35019 numMergedOcc 0
