0 mol 8 unq 0 iso 0 dist 7.77271 9.91124 9.07858 16.8935 16.8602 8.77457 numMergedOcc 0
1 mol 45 unq 0 iso 0 dist 7.61402 10.5468 7.95778 13.7903 6.39184 8.80014 numMergedOcc 0
2 mol 130 unq 0 iso 0 dist 6.16039 11.923 6.82089 6.87196 6.08911 9.13191 numMergedOcc 0
3 mol 130 unq 1 iso 0 dist 6.16039 11.923 6.82089 17.1 11.562 6.95405 numMergedOcc 0
4 mol 151 unq 0 iso 0 dist 7.48309 7.04946 5.63814 11.7392 8.3622 4.74531 numMergedOcc 0
5 mol 154 unq 0 iso 0 dist 9.39643 11.3475 6.28417 13.7738 4.70993 6.51014 numMergedOcc 0
6 mol 175 unq 0 iso 0 dist 9.15536 14.8807 7.01126 13.3081 4.30489 5.89564 numMergedOcc 0
7 mol 175 unq 1 iso 0 dist 9.15536 14.8807 7.01126 10.8434 4.57622 5.60528 numMergedOcc 0
8 mol 175 unq 2 iso 0 dist 9.15536 9.37871 6.58434 10.8434 4.57622 5.5995 numMergedOcc 0
9 mol 181 unq 0 iso 0 dist 9.7281 15.7969 7.96291 15.5799 9.08227 9.26796 numMergedOcc 0
10 mol 193 unq 0 iso 0 dist 8.52642 11.6364 7.94747 6.28889 4.17434 8.67745 numMergedOcc 0
11 mol 205 unq 0 iso 0 dist 7.70781 10.142 9.83885 14.7915 11.8917 5.95375 numMergedOcc 0
12 mol 205 unq 1 iso 0 dist 7.70781 6.37333 5.42696 14.7915 11.8917 9.17946 numMergedOcc 0
13 mol 210 unq 0 iso 0 dist 9.99958 7.2193 6.4829 11.4809 5.96222 5.57779 numMergedOcc 0
14 mol 210 unq 1 iso 0 dist 9.99958 7.2193 6.4829 14.1202 10.1011 7.05649 numMergedOcc 0
15 mol 210 unq 2 iso 0 dist 9.99958 7.2193 6.4829 12.4147 12.5026 6.78579 numMergedOcc 0
16 mol 210 unq 3 iso 0 dist 5.57537 5.20757 6.4829 8.78652 5.96222 5.57779 numMergedOcc 0
17 mol 210 unq 4 iso 0 dist 5.57537 5.20757 6.4829 9.01437 10.1011 7.05649 numMergedOcc 0
18 mol 210 unq 5 iso 0 dist 5.57537 5.20757 6.4829 10.9072 12.5026 6.78579 numMergedOcc 0
19 mol 213 unq 0 iso 0 dist 9.347 8.10535 7.37935 14.8294 9.84448 8.42053 numMergedOcc 0
20 mol 239 unq 0 iso 0 dist 8.5166 5.71442 7.18771 6.47859 5.2908 5.0804 numMergedOcc 0
21 mol 285 unq 0 iso 0 dist 7.15795 11.8168 5.80415 13.039 7.87216 8.16947 numMergedOcc 0
22 mol 285 unq 1 iso 0 dist 7.15795 11.8168 5.80415 9.23037 4.39689 6.74142 numMergedOcc 0
