0 mol 18 unq 0 iso 0 dist 9.1397 5.53824 9.30649 5.67577 9.46349 6.92705 numMergedOcc 0
1 mol 107 unq 0 iso 0 dist 9.45682 8.38463 7.82303 10.1994 5.31375 6.05753 numMergedOcc 0
2 mol 107 unq 1 iso 0 dist 9.45682 8.38463 7.82303 12.9752 6.49371 12.7816 numMergedOcc 0
3 mol 112 unq 0 iso 0 dist 6.87434 10.0814 9.34689 6.95317 5.92828 8.90959 numMergedOcc 0
4 mol 112 unq 1 iso 0 dist 6.87434 10.0814 9.34689 7.57713 9.1247 4.4941 numMergedOcc 0
5 mol 113 unq 0 iso 0 dist 9.59585 8.48288 8.28325 5.70579 4.30875 7.48733 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 4.80684 4.91594 8.34342 6.30721 4.55071 9.75037 numMergedOcc 0
7 mol 119 unq 1 iso 0 dist 4.80684 9.3046 7.62197 6.30721 4.55071 6.71103 numMergedOcc 0
8 mol 119 unq 2 iso 0 dist 4.80684 8.26819 9.31621 6.30721 4.55071 12.6399 numMergedOcc 0
9 mol 119 unq 3 iso 0 dist 7.60162 12.8318 8.34342 10.5082 4.55071 9.75037 numMergedOcc 0
10 mol 119 unq 4 iso 0 dist 7.60162 15.2217 7.62197 10.5082 4.55071 6.71103 numMergedOcc 0
11 mol 119 unq 5 iso 0 dist 7.60162 4.60974 9.31621 10.5082 4.55071 12.6399 numMergedOcc 0
12 mol 143 unq 0 iso 0 dist 8.64905 12.7056 7.22 7.39837 6.60366 6.16103 numMergedOcc 0
13 mol 152 unq 0 iso 0 dist 6.79114 7.78913 5.42715 4.94983 8.60651 10.6183 numMergedOcc 0
14 mol 152 unq 1 iso 0 dist 6.79114 5.70788 7.34557 4.94983 8.60651 4.71678 numMergedOcc 0
15 mol 169 unq 0 iso 0 dist 9.37946 8.78403 8.21203 5.7891 4.11374 7.59743 numMergedOcc 0
16 mol 194 unq 0 iso 0 dist 9.52922 6.66155 5.13892 10.0756 4.45769 5.28603 numMergedOcc 0
17 mol 194 unq 1 iso 0 dist 9.52922 6.66155 5.13892 16.4082 8.99961 10.7058 numMergedOcc 0
18 mol 194 unq 2 iso 0 dist 9.52922 5.4499 8.2232 10.0756 4.45769 11.0713 numMergedOcc 0
19 mol 194 unq 3 iso 0 dist 9.52922 5.4499 8.2232 16.4082 8.99961 16.9177 numMergedOcc 0
20 mol 194 unq 4 iso 0 dist 9.38984 11.971 5.78717 13.9836 5.89939 5.28603 numMergedOcc 0
21 mol 194 unq 5 iso 0 dist 9.38984 11.971 5.78717 13.9116 8.18853 10.7058 numMergedOcc 0
22 mol 194 unq 6 iso 0 dist 9.91118 13.2864 5.78717 15.5573 5.89939 5.28603 numMergedOcc 0
23 mol 194 unq 7 iso 0 dist 9.91118 13.2864 5.78717 16.1172 8.18853 10.7058 numMergedOcc 0
24 mol 252 unq 0 iso 0 dist 8.55044 8.24423 8.38453 12.2555 9.81261 4.34126 numMergedOcc 0
25 mol 292 unq 0 iso 0 dist 9.96374 9.84292 8.42359 17.5073 9.21469 11.4284 numMergedOcc 0
