0 mol 11 unq 0 iso 0 dist 9.64228 9.09133 6.55715 7.95375 8.21795 10.5476 9.76481 11.2277 14.5802 4.4678 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 8.36524 5.73257 8.90278 6.20159 13.7039 7.48759 7.66913 7.86199 4.41248 11.3492 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 6.84521 7.84444 8.01951 9.92963 15.4121 10.0341 9.35453 10.7805 4.73658 9.82546 numMergedOcc 0
3 mol 43 unq 1 iso 0 dist 6.84521 7.84444 8.01951 8.07389 8.42544 11.7792 9.35453 10.7805 4.73658 10.9858 numMergedOcc 0
4 mol 43 unq 2 iso 0 dist 8.90024 7.84444 12.2025 9.92963 18.4575 10.0341 9.35453 13.5667 4.73658 9.82546 numMergedOcc 0
5 mol 43 unq 3 iso 0 dist 8.90024 7.84444 12.2025 8.07389 6.09486 11.7792 9.35453 13.5667 4.73658 10.9858 numMergedOcc 0
6 mol 43 unq 4 iso 0 dist 6.78532 7.84444 7.68348 9.92963 13.9259 10.0341 9.35453 7.42491 4.73658 9.82546 numMergedOcc 0
7 mol 43 unq 5 iso 0 dist 6.78532 7.84444 7.68348 8.07389 4.40385 11.7792 9.35453 7.42491 4.73658 10.9858 numMergedOcc 0
8 mol 70 unq 0 iso 0 dist 6.77833 8.06918 6.65811 9.54062 10.1702 13.9104 6.13606 4.36555 9.29381 11.4024 numMergedOcc 0
9 mol 70 unq 1 iso 0 dist 6.77833 7.52623 5.47516 9.54062 10.1702 14.6351 6.13606 4.36555 6.40963 11.4024 numMergedOcc 0
10 mol 70 unq 2 iso 0 dist 6.77833 5.62294 11.0952 9.54062 10.1702 10.3843 6.13606 4.36555 8.69313 11.4024 numMergedOcc 0
11 mol 92 unq 0 iso 0 dist 9.96446 9.62702 10.9381 7.69672 12.6706 4.07654 6.15011 8.70803 13.5159 12.4367 numMergedOcc 0
12 mol 92 unq 1 iso 0 dist 9.96446 6.97484 12.1976 7.69672 12.6706 9.51614 6.15011 8.70803 6.50817 12.4367 numMergedOcc 0
13 mol 92 unq 2 iso 0 dist 6.70686 9.62702 7.17408 7.69672 8.52106 4.07654 6.15011 8.87994 13.5159 12.4367 numMergedOcc 0
14 mol 92 unq 3 iso 0 dist 6.70686 6.97484 10.944 7.69672 8.52106 9.51614 6.15011 8.87994 6.50817 12.4367 numMergedOcc 0
15 mol 154 unq 0 iso 0 dist 6.44195 5.81632 5.83431 5.7306 4.66975 8.54747 8.85675 10.0639 4.70993 11.9741 numMergedOcc 0
16 mol 154 unq 1 iso 0 dist 7.34207 5.81632 6.53652 5.7306 9.20471 8.54747 8.85675 5.27847 4.70993 11.9741 numMergedOcc 0
17 mol 205 unq 0 iso 0 dist 9.25882 6.37411 12.1001 6.254 6.16939 6.30764 6.32542 6.09749 11.9538 8.16279 numMergedOcc 0
18 mol 266 unq 0 iso 0 dist 6.95233 9.15288 4.27792 9.85095 5.60582 4.21036 8.31182 9.2768 9.15303 12.6333 numMergedOcc 0
19 mol 266 unq 1 iso 0 dist 6.95233 9.15288 4.27792 8.25191 10.3169 14.1747 8.31182 9.2768 9.15303 15.5391 numMergedOcc 0
20 mol 266 unq 2 iso 0 dist 6.95233 9.15288 4.27792 7.35056 9.69688 13.7096 8.31182 9.2768 9.15303 13.1627 numMergedOcc 0
21 mol 266 unq 3 iso 0 dist 6.95233 6.11795 11.5523 9.85095 5.60582 15.6867 8.31182 9.2768 9.68991 12.6333 numMergedOcc 0
22 mol 266 unq 4 iso 0 dist 6.95233 6.11795 11.5523 8.25191 10.3169 9.43694 8.31182 9.2768 9.68991 15.5391 numMergedOcc 0
23 mol 266 unq 5 iso 0 dist 6.95233 6.11795 11.5523 7.35056 9.69688 6.70962 8.31182 9.2768 9.68991 13.1627 numMergedOcc 0
24 mol 266 unq 6 iso 0 dist 9.61741 9.15288 14.2479 9.85095 17.1864 4.21036 8.31182 5.82477 9.15303 12.6333 numMergedOcc 0
25 mol 266 unq 7 iso 0 dist 9.61741 9.15288 14.2479 8.25191 15.5379 14.1747 8.31182 5.82477 9.15303 15.5391 numMergedOcc 0
26 mol 266 unq 8 iso 0 dist 9.61741 9.15288 14.2479 7.35056 12.4229 13.7096 8.31182 5.82477 9.15303 13.1627 numMergedOcc 0
27 mol 266 unq 9 iso 0 dist 9.61741 6.11795 6.98866 9.85095 17.1864 15.6867 8.31182 5.82477 9.68991 12.6333 numMergedOcc 0
28 mol 266 unq 10 iso 0 dist 9.61741 6.11795 6.98866 8.25191 15.5379 9.43694 8.31182 5.82477 9.68991 15.5391 numMergedOcc 0
29 mol 266 unq 11 iso 0 dist 9.61741 6.11795 6.98866 7.35056 12.4229 6.70962 8.31182 5.82477 9.68991 13.1627 numMergedOcc 0
30 mol 266 unq 12 iso 0 dist 5.61056 9.15288 10.5058 9.85095 12.5903 4.21036 8.31182 7.15796 9.15303 12.6333 numMergedOcc 0
31 mol 266 unq 13 iso 0 dist 5.61056 9.15288 10.5058 8.25191 9.37668 14.1747 8.31182 7.15796 9.15303 15.5391 numMergedOcc 0
32 mol 266 unq 14 iso 0 dist 5.61056 9.15288 10.5058 7.35056 6.29234 13.7096 8.31182 7.15796 9.15303 13.1627 numMergedOcc 0
33 mol 266 unq 15 iso 0 dist 5.61056 6.11795 5.19574 9.85095 12.5903 15.6867 8.31182 7.15796 9.68991 12.6333 numMergedOcc 0
34 mol 266 unq 16 iso 0 dist 5.61056 6.11795 5.19574 8.25191 9.37668 9.43694 8.31182 7.15796 9.68991 15.5391 numMergedOcc 0
35 mol 266 unq 17 iso 0 dist 5.61056 6.11795 5.19574 7.35056 6.29234 6.70962 8.31182 7.15796 9.68991 13.1627 numMergedOcc 0
36 mol 273 unq 0 iso 0 dist 9.79022 9.93542 7.00883 8.20612 4.01113 9.08 6.59092 7.81483 6.2726 9.23974 numMergedOcc 0
37 mol 277 unq 0 iso 0 dist 9.38793 9.28545 17.5025 7.89017 13.9139 6.90812 7.64361 16.4697 5.7252 6.17749 numMergedOcc 0
38 mol 280 unq 0 iso 0 dist 6.52188 6.78323 6.24406 8.89904 9.89602 6.07839 9.35785 10.173 4.12456 4.71431 numMergedOcc 0
