0 mol 13 unq 0 iso 0 dist 6.02651 4.72753 6.11444 10.6358 6.70295 8.47514 numMergedOcc 0
1 mol 13 unq 1 iso 0 dist 6.02651 4.72753 6.11444 10.261 5.61058 7.39086 numMergedOcc 0
2 mol 29 unq 0 iso 0 dist 8.53135 7.27473 7.28761 15.7177 13.735 8.94936 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 7.67459 11.1757 7.32236 15.8918 13.1056 9.07906 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 7.67459 11.1757 7.32236 19.2466 13.0177 8.75567 numMergedOcc 0
5 mol 43 unq 2 iso 0 dist 7.62469 10.1488 8.90701 9.17086 5.39546 9.89546 numMergedOcc 0
6 mol 81 unq 0 iso 0 dist 6.9055 8.83867 6.95637 10.9243 4.32473 7.19581 numMergedOcc 0
7 mol 120 unq 0 iso 0 dist 8.8894 6.52836 6.14769 14.7662 10.5565 8.5457 numMergedOcc 0
8 mol 120 unq 1 iso 0 dist 8.8894 6.52836 6.14769 12.9136 6.75714 6.7928 numMergedOcc 0
9 mol 120 unq 2 iso 0 dist 8.8894 6.52836 6.14769 11.8319 4.93797 7.59189 numMergedOcc 0
10 mol 152 unq 0 iso 0 dist 9.27341 12.2127 9.17101 16.0753 13.793 8.86966 numMergedOcc 0
11 mol 152 unq 1 iso 0 dist 9.27341 12.2127 9.17101 16.0158 11.2124 5.7527 numMergedOcc 0
12 mol 170 unq 0 iso 0 dist 9.15159 12.8766 7.45761 10.867 4.81264 6.01758 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 9.60838 11.4066 8.11956 14.3771 5.25279 9.37545 numMergedOcc 0
14 mol 186 unq 1 iso 0 dist 9.60838 11.4066 8.11956 16.0183 9.29114 6.02579 numMergedOcc 0
15 mol 192 unq 0 iso 0 dist 5.83093 8.82579 5.90008 14.685 9.17442 8.63044 numMergedOcc 0
16 mol 210 unq 0 iso 0 dist 8.50367 7.54885 6.93215 11.7997 5.92474 5.62219 numMergedOcc 0
17 mol 210 unq 1 iso 0 dist 8.94889 10.4785 6.93215 12.598 5.92474 5.62219 numMergedOcc 0
18 mol 261 unq 0 iso 0 dist 8.96253 4.34203 5.46946 13.196 7.89933 9.00426 numMergedOcc 0
19 mol 261 unq 1 iso 0 dist 8.96253 6.7438 8.24264 13.196 7.89933 8.19348 numMergedOcc 0
20 mol 261 unq 2 iso 0 dist 8.25759 14.9805 9.66703 14.5006 6.79406 8.19348 numMergedOcc 0
21 mol 282 unq 0 iso 0 dist 8.30313 14.1269 9.82919 13.7887 6.62554 8.39723 numMergedOcc 0
22 mol 283 unq 0 iso 0 dist 6.93798 8.33215 4.1631 14.9809 8.37369 8.25636 numMergedOcc 0
23 mol 287 unq 0 iso 0 dist 9.30394 4.70335 9.82863 11.5917 12.5774 9.29241 numMergedOcc 0
24 mol 287 unq 1 iso 0 dist 5.84467 9.38112 9.82863 11.8739 12.5774 9.29241 numMergedOcc 0
25 mol 288 unq 0 iso 0 dist 9.30394 4.70335 9.82863 11.5917 12.5774 9.29241 numMergedOcc 0
26 mol 288 unq 1 iso 0 dist 5.84467 9.38112 9.82863 11.8739 12.5774 9.29241 numMergedOcc 0
27 mol 289 unq 0 iso 0 dist 9.30394 4.70335 9.82863 11.5917 12.5774 9.29241 numMergedOcc 0
28 mol 289 unq 1 iso 0 dist 5.84467 9.38112 9.82863 11.8739 12.5774 9.29241 numMergedOcc 0
