0 mol 34 unq 0 iso 0 dist 5.77643 5.51172 4.22398 4.71262 7.79336 7.01952 numMergedOcc 0
1 mol 34 unq 1 iso 0 dist 5.77643 5.51172 4.22398 4.28439 7.08559 4.58552 numMergedOcc 0
2 mol 34 unq 2 iso 0 dist 8.8197 7.93454 4.53851 12.5404 9.72194 7.01952 numMergedOcc 0
3 mol 34 unq 3 iso 0 dist 8.8197 9.06898 5.31195 12.5404 9.72194 4.58552 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 9.62096 8.52697 17.0218 3.89377 12.8463 8.64934 numMergedOcc 0
5 mol 79 unq 1 iso 0 dist 7.93317 8.52697 13.5391 3.89377 11.3504 8.64934 numMergedOcc 0
6 mol 79 unq 2 iso 0 dist 7.11013 8.52697 4.1859 3.89377 6.52939 8.64934 numMergedOcc 0
7 mol 93 unq 0 iso 0 dist 5.77804 5.46186 9.18194 6.81453 12.3562 7.23305 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 9.36283 9.21978 6.04071 3.85674 10.2461 7.65564 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 9.71611 4.54218 6.8823 6.90735 10.827 7.92216 numMergedOcc 0
10 mol 141 unq 1 iso 0 dist 7.1093 4.54218 4.22522 6.90735 12.0433 7.92216 numMergedOcc 0
11 mol 141 unq 2 iso 0 dist 7.36421 8.36316 4.22522 13.0345 12.0433 7.92216 numMergedOcc 0
12 mol 146 unq 0 iso 0 dist 6.66451 6.76896 4.23789 3.75935 5.41078 7.78784 numMergedOcc 0
13 mol 157 unq 0 iso 0 dist 7.36432 8.51753 5.38303 6.17631 10.4299 8.40821 numMergedOcc 0
14 mol 157 unq 1 iso 0 dist 7.36432 8.51753 5.38303 3.80096 10.4422 9.86925 numMergedOcc 0
15 mol 178 unq 0 iso 0 dist 8.71031 5.4647 5.88866 3.93042 9.87734 7.86352 numMergedOcc 0
16 mol 213 unq 0 iso 0 dist 8.6925 5.81317 5.9858 6.49084 5.461 7.90657 numMergedOcc 0
17 mol 233 unq 0 iso 0 dist 7.40764 9.79864 6.80416 5.47357 8.24424 9.01338 numMergedOcc 0
18 mol 243 unq 0 iso 0 dist 9.85284 9.49016 10.9216 12.1329 13.4921 8.30024 numMergedOcc 0
19 mol 243 unq 1 iso 0 dist 9.85284 9.49016 10.9216 6.41173 11.4329 8.20943 numMergedOcc 0
