0 mol 43 unq 0 iso 0 dist 8.90024 9.35453 13.5667 14.9559 8.38387 20.2421 14.6778 8.03754 17.5911 4.99287 numMergedOcc 0
1 mol 109 unq 0 iso 0 dist 6.43255 9.88541 9.29894 13.5611 8.3164 15.5751 9.88245 9.41191 17.7874 12.6973 numMergedOcc 0
2 mol 133 unq 0 iso 0 dist 8.66715 9.29665 17.3196 13.3005 9.50322 21.4686 16.6927 9.1146 23.7184 15.9933 numMergedOcc 0
3 mol 134 unq 0 iso 0 dist 8.84656 7.85849 5.29786 18.3189 9.60411 12.1527 15.0514 6.48328 11.0888 5.73962 numMergedOcc 0
4 mol 154 unq 0 iso 0 dist 7.34207 8.85675 5.27847 9.95968 6.23399 10.5035 6.84292 6.36439 10.5028 3.82471 numMergedOcc 0
5 mol 236 unq 0 iso 0 dist 8.95071 5.27184 9.52712 9.48296 5.66569 10.483 5.81446 5.90804 5.91739 4.60599 numMergedOcc 0
6 mol 236 unq 1 iso 0 dist 8.95071 5.27184 9.52712 5.05085 6.11137 8.37813 5.81446 5.90804 5.91739 4.24722 numMergedOcc 0
7 mol 236 unq 2 iso 0 dist 8.95071 7.98527 9.82639 9.48296 5.66569 14.0081 5.81446 5.90804 10.9794 4.60599 numMergedOcc 0
8 mol 236 unq 3 iso 0 dist 8.95071 7.98527 9.82639 5.05085 6.11137 10.4481 5.81446 5.90804 10.9794 4.24722 numMergedOcc 0
9 mol 277 unq 0 iso 0 dist 7.23956 6.71956 7.70529 12.7088 9.29635 16.1262 10.2688 4.81916 9.35976 12.5633 numMergedOcc 0
10 mol 287 unq 0 iso 0 dist 7.95849 8.25538 13.2859 8.55612 9.53313 10.1363 5.51191 9.32175 12.8377 8.80315 numMergedOcc 0
11 mol 287 unq 1 iso 0 dist 7.95849 8.25538 13.2859 4.91435 7.26542 8.42076 5.51191 9.32175 12.8377 6.53276 numMergedOcc 0
12 mol 288 unq 0 iso 0 dist 7.95849 8.25538 13.2859 8.55612 9.53313 10.1363 5.51191 9.32175 12.8377 8.80315 numMergedOcc 0
13 mol 288 unq 1 iso 0 dist 7.95849 8.25538 13.2859 4.91435 7.26542 8.42076 5.51191 9.32175 12.8377 6.53276 numMergedOcc 0
14 mol 289 unq 0 iso 0 dist 7.95849 8.25538 13.2859 8.55612 9.53313 10.1363 5.51191 9.32175 12.8377 8.80315 numMergedOcc 0
15 mol 289 unq 1 iso 0 dist 7.95849 8.25538 13.2859 4.91435 7.26542 8.42076 5.51191 9.32175 12.8377 6.53276 numMergedOcc 0
