0 mol 0 unq 0 iso 0 dist 8.38106 9.46626 5.56616 6.64852 6.8892 11.1413 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 5.70193 8.32195 5.56616 6.26414 6.8892 11.1413 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 6.68091 9.86938 6.88402 4.04843 8.68949 8.70858 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 9.65672 8.84323 6.03786 14.3275 9.11512 14.2974 numMergedOcc 0
4 mol 67 unq 0 iso 0 dist 8.34804 5.70192 13.1761 10.7182 8.27009 14.7518 numMergedOcc 0
5 mol 67 unq 1 iso 0 dist 8.34804 5.70192 13.1761 5.66613 5.80736 11.3612 numMergedOcc 0
6 mol 79 unq 0 iso 0 dist 8.01516 9.07582 5.79235 15.8477 8.64686 12.2143 numMergedOcc 0
7 mol 123 unq 0 iso 0 dist 7.15869 6.7201 8.8027 8.29205 9.92281 13.5844 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 9.96416 6.73897 7.50288 5.9683 5.79195 8.03691 numMergedOcc 0
9 mol 133 unq 1 iso 0 dist 7.17051 6.73897 8.01541 5.9683 9.2759 8.03691 numMergedOcc 0
10 mol 133 unq 2 iso 0 dist 5.9962 6.73897 5.31306 5.9683 8.76088 8.03691 numMergedOcc 0
11 mol 133 unq 3 iso 0 dist 8.61448 8.9344 6.95294 13.8877 8.76088 15.3705 numMergedOcc 0
12 mol 174 unq 0 iso 0 dist 4.77805 8.3622 6.26251 5.75017 7.27146 11.8921 numMergedOcc 0
13 mol 174 unq 1 iso 0 dist 4.77805 8.3622 6.26251 6.92858 6.25798 12.0957 numMergedOcc 0
14 mol 187 unq 0 iso 0 dist 5.82577 8.26654 8.43209 10.7172 5.58167 12.2628 numMergedOcc 0
15 mol 187 unq 1 iso 0 dist 5.82577 8.26654 8.43209 4.75665 8.0501 12.9656 numMergedOcc 0
16 mol 236 unq 0 iso 0 dist 8.20542 6.98151 11.4732 4.60599 8.63249 10.3387 numMergedOcc 0
17 mol 243 unq 0 iso 0 dist 7.93817 9.46855 5.83664 4.73439 7.70472 8.62303 numMergedOcc 0
18 mol 243 unq 1 iso 0 dist 7.93817 9.46855 5.83664 9.17097 9.16988 8.75924 numMergedOcc 0
19 mol 285 unq 0 iso 0 dist 5.76796 8.96754 8.9423 11.2606 7.872 15.1463 numMergedOcc 0
20 mol 285 unq 1 iso 0 dist 5.76796 8.96754 8.9423 8.7778 6.32984 14.9236 numMergedOcc 0
