0 mol 11 unq 0 iso 0 dist 6.49709 4.4067 8.68293 10.6872 7.86896 9.08736 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 6.49709 13.2938 6.84216 10.6872 7.86896 9.74528 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.06275 7.62357 9.02471 11.0353 4.80528 8.81562 numMergedOcc 0
3 mol 43 unq 1 iso 0 dist 8.90024 16.9091 9.02471 11.5942 4.80528 8.81562 numMergedOcc 0
4 mol 95 unq 0 iso 0 dist 7.90775 6.56529 7.51733 5.84349 4.33346 9.02905 numMergedOcc 0
5 mol 122 unq 0 iso 0 dist 8.47907 12.1473 4.42563 14.0011 6.28781 4.821 numMergedOcc 0
6 mol 143 unq 0 iso 0 dist 7.73769 11.099 8.64905 17.9423 17.4764 9.99012 numMergedOcc 0
7 mol 143 unq 1 iso 0 dist 7.73769 11.099 8.64905 10.4073 5.11989 5.33772 numMergedOcc 0
8 mol 152 unq 0 iso 0 dist 8.34839 14.1262 9.00072 21.4719 14.7437 9.07315 numMergedOcc 0
9 mol 167 unq 0 iso 0 dist 6.53913 5.60897 5.36671 13.2553 8.88239 8.06817 numMergedOcc 0
10 mol 205 unq 0 iso 0 dist 8.57514 13.7017 9.31158 21.3794 14.3203 8.83628 numMergedOcc 0
11 mol 205 unq 1 iso 0 dist 6.11505 13.9601 9.31158 20.1958 14.3203 8.83628 numMergedOcc 0
12 mol 206 unq 0 iso 0 dist 5.82039 12.4707 9.4629 12.0866 7.20088 5.73198 numMergedOcc 0
13 mol 214 unq 0 iso 0 dist 7.94344 10.313 9.06459 15.8652 14.5108 9.46274 numMergedOcc 0
14 mol 252 unq 0 iso 0 dist 7.91348 5.45887 8.55044 5.41885 5.96471 9.09279 numMergedOcc 0
15 mol 266 unq 0 iso 0 dist 6.95233 4.5731 9.29666 6.20998 5.98169 4.95415 numMergedOcc 0
16 mol 266 unq 1 iso 0 dist 6.95233 4.5731 9.29666 8.78219 13.8919 6.38519 numMergedOcc 0
17 mol 277 unq 0 iso 0 dist 8.53324 9.7252 7.42932 12.3059 10.4297 4.1545 numMergedOcc 0
18 mol 277 unq 1 iso 0 dist 7.23956 9.7252 4.9764 12.3059 5.77904 4.1545 numMergedOcc 0
19 mol 277 unq 2 iso 0 dist 7.23956 10.5201 6.36559 12.3059 5.77904 4.25172 numMergedOcc 0
20 mol 277 unq 3 iso 0 dist 8.66941 10.3675 7.42932 14.4938 10.4297 4.1545 numMergedOcc 0
21 mol 285 unq 0 iso 0 dist 9.82717 13.5711 6.71946 11.6641 5.93692 6.07843 numMergedOcc 0
22 mol 285 unq 1 iso 0 dist 9.82717 13.8352 5.03601 15.001 9.237 7.08681 numMergedOcc 0
23 mol 285 unq 2 iso 0 dist 9.82717 13.8352 5.03601 11.6641 5.93692 9.66678 numMergedOcc 0
24 mol 285 unq 3 iso 0 dist 8.33653 7.76515 6.71946 8.17214 5.93692 6.07843 numMergedOcc 0
25 mol 285 unq 4 iso 0 dist 8.33653 7.52611 5.03601 13.1171 9.237 7.08681 numMergedOcc 0
26 mol 285 unq 5 iso 0 dist 8.33653 7.52611 5.03601 8.17214 5.93692 9.66678 numMergedOcc 0
27 mol 285 unq 6 iso 0 dist 6.44657 11.6832 6.71946 11.464 5.93692 6.07843 numMergedOcc 0
28 mol 285 unq 7 iso 0 dist 6.44657 5.32175 5.03601 4.49395 9.237 7.08681 numMergedOcc 0
29 mol 285 unq 8 iso 0 dist 6.44657 5.32175 5.03601 11.464 5.93692 9.66678 numMergedOcc 0
30 mol 287 unq 0 iso 0 dist 7.95849 7.22067 9.76232 4.98604 5.10722 8.73403 numMergedOcc 0
31 mol 288 unq 0 iso 0 dist 7.95849 7.22067 9.76232 4.98604 5.10722 8.73403 numMergedOcc 0
32 mol 289 unq 0 iso 0 dist 7.95849 7.22067 9.76232 4.98604 5.10722 8.73403 numMergedOcc 0
