0 mol 32 unq 0 iso 0 dist 7.98414 8.35776 10.8132 11.3409 15.9404 5.78231 numMergedOcc 0
1 mol 32 unq 1 iso 0 dist 7.98414 8.35776 10.8132 8.8719 10.0514 9.41538 numMergedOcc 0
2 mol 46 unq 0 iso 0 dist 6.35731 7.12713 3.57198 8.08636 8.79504 5.81662 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 8.95848 5.23167 5.85606 6.37499 12.3465 6.51901 numMergedOcc 0
4 mol 62 unq 1 iso 0 dist 8.95848 5.23167 5.85606 11.7209 14.136 9.1926 numMergedOcc 0
5 mol 62 unq 2 iso 0 dist 9.15189 7.47607 5.85606 9.79569 12.3465 6.51901 numMergedOcc 0
6 mol 62 unq 3 iso 0 dist 9.15189 7.47607 5.85606 13.1832 14.136 9.1926 numMergedOcc 0
7 mol 93 unq 0 iso 0 dist 8.6701 6.06155 9.11323 4.54745 7.24843 8.2702 numMergedOcc 0
8 mol 93 unq 1 iso 0 dist 6.85457 6.06155 8.52329 4.54745 7.63783 8.2702 numMergedOcc 0
9 mol 96 unq 0 iso 0 dist 9.46918 7.40983 6.53944 8.67044 10.0967 7.22615 numMergedOcc 0
10 mol 96 unq 1 iso 0 dist 7.64681 7.40983 7.86339 8.67044 12.4555 7.22615 numMergedOcc 0
11 mol 109 unq 0 iso 0 dist 6.65318 4.30961 4.0719 5.67628 9.32181 8.71568 numMergedOcc 0
12 mol 109 unq 1 iso 0 dist 6.65318 4.30961 4.0719 4.86796 8.46446 5.81859 numMergedOcc 0
13 mol 113 unq 0 iso 0 dist 5.7085 6.38269 6.29259 13.5639 15.3806 9.44 numMergedOcc 0
14 mol 113 unq 1 iso 0 dist 5.7085 7.11196 7.08122 13.5639 15.3806 8.47634 numMergedOcc 0
15 mol 123 unq 0 iso 0 dist 8.29394 7.49032 4.10526 4.20645 11.2105 9.72421 numMergedOcc 0
16 mol 123 unq 1 iso 0 dist 8.29394 7.49032 4.10526 9.0296 7.36361 8.35926 numMergedOcc 0
17 mol 123 unq 2 iso 0 dist 5.98534 7.04627 4.10526 6.60637 11.2105 9.72421 numMergedOcc 0
18 mol 123 unq 3 iso 0 dist 5.98534 7.04627 4.10526 6.33531 7.36361 8.35926 numMergedOcc 0
19 mol 130 unq 0 iso 0 dist 9.73325 9.48604 3.90693 5.92054 5.65876 7.50304 numMergedOcc 0
20 mol 194 unq 0 iso 0 dist 7.27978 9.3032 3.7326 10.4172 7.71806 4.55528 numMergedOcc 0
21 mol 194 unq 1 iso 0 dist 7.27978 9.3032 3.7326 13.6082 9.59959 6.88386 numMergedOcc 0
22 mol 225 unq 0 iso 0 dist 8.65088 7.22151 3.87855 4.40718 8.84033 5.65735 numMergedOcc 0
23 mol 252 unq 0 iso 0 dist 6.7021 4.15692 3.99887 4.87406 8.35637 5.2116 numMergedOcc 0
24 mol 266 unq 0 iso 0 dist 6.99089 7.51951 4.72338 4.00824 10.358 9.2684 numMergedOcc 0
25 mol 278 unq 0 iso 0 dist 8.31165 8.69111 8.79088 4.25803 9.62872 7.73107 numMergedOcc 0
26 mol 284 unq 0 iso 0 dist 9.95662 5.06373 9.94624 4.29335 13.6175 5.2862 numMergedOcc 0
27 mol 284 unq 1 iso 0 dist 9.95662 5.06373 9.94624 6.24981 13.2942 5.31097 numMergedOcc 0
