0 mol 0 unq 0 iso 0 dist 9.16606 9.83355 14.8746 8.65478 13.4692 18.0375 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 9.16606 8.88219 10.6886 8.65478 13.4692 11.2646 numMergedOcc 0
2 mol 5 unq 0 iso 0 dist 6.99733 9.7907 5.36928 7.88567 5.34991 3.99476 numMergedOcc 0
3 mol 10 unq 0 iso 0 dist 7.5169 9.64891 5.84475 7.30932 6.62276 4.71687 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 8.65828 7.85234 13.1418 8.36742 4.28862 14.7888 numMergedOcc 0
5 mol 26 unq 1 iso 0 dist 8.65828 7.85234 13.1418 8.10028 4.93643 12.7914 numMergedOcc 0
6 mol 28 unq 0 iso 0 dist 8.40467 9.6867 6.67638 8.91922 9.71507 6.5312 numMergedOcc 0
7 mol 28 unq 1 iso 0 dist 8.40467 5.13138 6.29954 8.91922 9.71507 4.45307 numMergedOcc 0
8 mol 28 unq 2 iso 0 dist 7.24073 6.62196 5.6954 6.42785 10.1805 5.7604 numMergedOcc 0
9 mol 28 unq 3 iso 0 dist 7.24073 7.61351 5.18775 6.42785 10.1805 9.25982 numMergedOcc 0
10 mol 28 unq 4 iso 0 dist 8.24422 9.6147 8.95481 5.75809 8.89273 9.25982 numMergedOcc 0
11 mol 28 unq 5 iso 0 dist 8.99724 9.6147 13.1923 5.75809 8.10455 9.25982 numMergedOcc 0
12 mol 37 unq 0 iso 0 dist 9.21102 9.70008 7.39428 8.5893 12.5114 6.86666 numMergedOcc 0
13 mol 37 unq 1 iso 0 dist 6.84257 9.70008 6.10776 8.5893 6.15909 6.86666 numMergedOcc 0
14 mol 83 unq 0 iso 0 dist 8.49115 6.07337 8.2192 9.98298 8.84888 5.69217 numMergedOcc 0
15 mol 83 unq 1 iso 0 dist 8.49115 6.07337 8.2192 7.55036 4.18675 5.29439 numMergedOcc 0
16 mol 83 unq 2 iso 0 dist 8.49115 6.07337 8.2192 8.32248 7.23248 10.3919 numMergedOcc 0
17 mol 98 unq 0 iso 0 dist 4.3521 8.70888 5.88978 5.24616 8.734 10.4429 numMergedOcc 0
18 mol 98 unq 1 iso 0 dist 9.20236 9.60416 16.4595 5.85622 14.7898 8.67903 numMergedOcc 0
19 mol 131 unq 0 iso 0 dist 4.56886 9.13081 6.32847 7.382 3.82317 4.9293 numMergedOcc 0
20 mol 141 unq 0 iso 0 dist 8.5614 5.77628 11.3907 4.93944 6.1672 5.50466 numMergedOcc 0
21 mol 147 unq 0 iso 0 dist 9.61 9.95533 9.74349 8.92048 3.7035 7.88487 numMergedOcc 0
22 mol 151 unq 0 iso 0 dist 7.93343 7.28665 13.6145 8.16646 8.30893 13.6706 numMergedOcc 0
23 mol 151 unq 1 iso 0 dist 5.89468 7.28665 9.79713 8.16646 10.4799 13.6706 numMergedOcc 0
24 mol 186 unq 0 iso 0 dist 7.6409 9.03496 4.89182 7.62945 5.28021 9.42515 numMergedOcc 0
25 mol 193 unq 0 iso 0 dist 8.71993 7.46207 9.78229 6.10013 4.8988 5.43768 numMergedOcc 0
26 mol 209 unq 0 iso 0 dist 6.74526 9.93982 9.79525 9.81506 4.19179 12.9933 numMergedOcc 0
27 mol 209 unq 1 iso 0 dist 8.12326 9.93982 7.48645 9.81506 6.28791 12.9933 numMergedOcc 0
28 mol 274 unq 0 iso 0 dist 7.79173 9.44207 5.99306 7.70811 6.93195 8.42538 numMergedOcc 0
29 mol 281 unq 0 iso 0 dist 7.76659 7.50258 5.80895 9.04679 6.93787 7.3976 numMergedOcc 0
30 mol 281 unq 1 iso 0 dist 6.47753 8.92291 3.87789 9.49871 4.93084 6.51394 numMergedOcc 0
31 mol 291 unq 0 iso 0 dist 9.20449 9.42785 4.58354 7.02207 12.4309 9.78238 numMergedOcc 0
