0 mol 7 unq 0 iso 0 dist 6.22805 5.85668 7.15434 5.99355 5.72491 7.29541 numMergedOcc 0
1 mol 56 unq 0 iso 0 dist 8.54845 10.2322 9.77018 14.6671 8.63486 7.79856 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 7.14865 10.0636 9.20523 7.12794 7.9814 7.80321 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 6.30194 6.13631 8.124 14.8714 8.73253 16.0036 numMergedOcc 0
4 mol 109 unq 0 iso 0 dist 8.39771 16.9308 9.45397 14.6851 7.55384 9.01694 numMergedOcc 0
5 mol 124 unq 0 iso 0 dist 7.23052 9.2094 6.35314 10.0311 8.58188 4.85358 numMergedOcc 0
6 mol 134 unq 0 iso 0 dist 7.97208 6.50741 5.57904 11.5403 5.53031 5.98568 numMergedOcc 0
7 mol 140 unq 0 iso 0 dist 8.36882 7.32877 7.83582 8.92003 5.39064 11.3235 numMergedOcc 0
8 mol 210 unq 0 iso 0 dist 6.53736 7.79985 8.71409 5.06201 5.37446 3.99796 numMergedOcc 0
9 mol 210 unq 1 iso 0 dist 8.18851 9.95839 8.71409 6.66834 5.37446 3.99796 numMergedOcc 0
10 mol 212 unq 0 iso 0 dist 7.87125 4.78007 9.47932 13.7645 6.29767 14.3725 numMergedOcc 0
11 mol 212 unq 1 iso 0 dist 7.87125 4.78007 9.47932 6.39716 8.74585 11.0448 numMergedOcc 0
12 mol 220 unq 0 iso 0 dist 8.9077 11.9931 6.21273 5.41948 5.45036 6.71715 numMergedOcc 0
13 mol 220 unq 1 iso 0 dist 8.9077 11.9931 6.21273 15.1445 9.97586 10.938 numMergedOcc 0
14 mol 230 unq 0 iso 0 dist 8.33847 11.8106 5.62804 5.02022 6.41286 10.1088 numMergedOcc 0
15 mol 230 unq 1 iso 0 dist 9.12305 11.2815 5.62804 9.81615 6.41286 10.1088 numMergedOcc 0
16 mol 232 unq 0 iso 0 dist 7.47238 16.9546 9.95045 6.4535 7.83711 16.7146 numMergedOcc 0
17 mol 240 unq 0 iso 0 dist 6.01168 11.1967 9.68888 14.3522 9.47583 17.2138 numMergedOcc 0
18 mol 240 unq 1 iso 0 dist 6.83069 9.79222 9.68888 8.30926 9.47583 17.2138 numMergedOcc 0
19 mol 258 unq 0 iso 0 dist 7.9357 7.88062 8.21585 11.517 7.99477 12.2193 numMergedOcc 0
20 mol 258 unq 1 iso 0 dist 7.9357 7.88062 8.21585 5.04382 7.86627 8.45446 numMergedOcc 0
21 mol 258 unq 2 iso 0 dist 8.81059 5.79358 8.21585 15.4617 7.99477 12.2193 numMergedOcc 0
22 mol 258 unq 3 iso 0 dist 8.81059 5.79358 8.21585 11.0527 7.86627 8.45446 numMergedOcc 0
23 mol 272 unq 0 iso 0 dist 6.62923 11.1133 7.31993 14.4134 9.19033 11.4436 numMergedOcc 0
