0 mol 30 unq 0 iso 0 dist 9.39028 11.2318 7.85546 15.588 6.38009 9.39194 numMergedOcc 0
1 mol 30 unq 1 iso 0 dist 9.39028 11.2318 7.85546 16.938 11.1138 7.30322 numMergedOcc 0
2 mol 92 unq 0 iso 0 dist 5.19645 9.51738 8.62881 10.3808 6.882 6.35305 numMergedOcc 0
3 mol 93 unq 0 iso 0 dist 8.6701 4.54745 7.24843 10.7186 5.01255 8.23294 numMergedOcc 0
4 mol 93 unq 1 iso 0 dist 8.6701 4.54745 7.24843 6.06155 9.11323 8.2702 numMergedOcc 0
5 mol 93 unq 2 iso 0 dist 6.85457 4.54745 7.63783 10.7186 8.98901 8.23294 numMergedOcc 0
6 mol 93 unq 3 iso 0 dist 6.85457 4.54745 7.63783 6.06155 8.52329 8.2702 numMergedOcc 0
7 mol 109 unq 0 iso 0 dist 6.65318 5.67628 9.32181 4.30961 4.0719 8.71568 numMergedOcc 0
8 mol 109 unq 1 iso 0 dist 6.65318 4.86796 8.46446 4.30961 4.0719 5.81859 numMergedOcc 0
9 mol 123 unq 0 iso 0 dist 8.29394 9.0296 7.36361 14.9057 7.88813 8.09682 numMergedOcc 0
10 mol 123 unq 1 iso 0 dist 8.29394 9.0296 7.36361 7.49032 4.10526 8.35926 numMergedOcc 0
11 mol 123 unq 2 iso 0 dist 8.29394 9.0296 7.36361 15.9261 12.6384 7.41568 numMergedOcc 0
12 mol 123 unq 3 iso 0 dist 5.98534 6.33531 7.36361 11.7928 7.88813 8.09682 numMergedOcc 0
13 mol 123 unq 4 iso 0 dist 5.98534 6.33531 7.36361 7.04627 4.10526 8.35926 numMergedOcc 0
14 mol 123 unq 5 iso 0 dist 5.98534 6.33531 7.36361 13.6512 12.6384 7.41568 numMergedOcc 0
15 mol 130 unq 0 iso 0 dist 9.73325 5.92054 5.65876 9.48604 3.90693 7.50304 numMergedOcc 0
16 mol 173 unq 0 iso 0 dist 9.70728 12.0232 6.07708 18.3287 8.66075 9.31914 numMergedOcc 0
17 mol 181 unq 0 iso 0 dist 9.91457 9.73235 9.0234 11.2828 3.63671 7.24832 numMergedOcc 0
18 mol 194 unq 0 iso 0 dist 7.27978 10.4172 7.71806 9.3032 3.7326 4.55528 numMergedOcc 0
19 mol 194 unq 1 iso 0 dist 7.27978 10.4172 7.71806 12.7181 7.29209 4.42095 numMergedOcc 0
20 mol 225 unq 0 iso 0 dist 8.65088 4.40718 8.84033 12.073 11.7688 8.52735 numMergedOcc 0
21 mol 225 unq 1 iso 0 dist 8.65088 4.40718 8.84033 7.22151 3.87855 5.65735 numMergedOcc 0
22 mol 252 unq 0 iso 0 dist 6.7021 4.87406 8.35637 4.15692 3.99887 5.2116 numMergedOcc 0
23 mol 278 unq 0 iso 0 dist 8.31165 4.25803 9.62872 8.69111 8.79088 7.73107 numMergedOcc 0
