0 mol 29 unq 0 iso 0 dist 7.71924 5.36278 8.02814 5.3571 7.71617 9.78134 8.9204 4.40181 7.29489 9.41017 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 8.4438 4.34694 9.65371 4.93697 7.75341 7.47162 6.82707 7.94629 10.5011 8.4701 numMergedOcc 0
2 mol 79 unq 0 iso 0 dist 7.41952 8.64686 9.57704 11.5374 16.3634 8.26763 9.21479 12.295 9.40625 9.77084 numMergedOcc 0
3 mol 79 unq 1 iso 0 dist 7.41952 8.64686 9.57704 5.21981 10.7273 6.30814 9.21479 12.295 9.40625 6.5551 numMergedOcc 0
4 mol 91 unq 0 iso 0 dist 5.78962 8.91354 7.47242 5.09341 7.77953 9.84288 6.93893 9.0185 5.06999 8.77355 numMergedOcc 0
5 mol 159 unq 0 iso 0 dist 7.60912 9.9368 13.4546 15.7186 19.6156 9.45909 24.8356 27.6403 17.2892 9.35202 numMergedOcc 0
6 mol 210 unq 0 iso 0 dist 6.41444 8.05949 7.48216 10.8542 10.0723 7.80421 17.1665 13.302 10.4519 9.68477 numMergedOcc 0
7 mol 239 unq 0 iso 0 dist 8.34832 8.48545 14.2079 3.28983 6.64008 9.993 6.91534 15.1473 9.08479 8.95511 numMergedOcc 0
8 mol 239 unq 1 iso 0 dist 8.34832 8.48545 14.2079 3.28983 6.64008 9.993 9.05892 6.62656 15.0274 5.85002 numMergedOcc 0
9 mol 244 unq 0 iso 0 dist 6.51428 7.79787 13.4155 8.65358 13.2708 8.93589 9.97458 16.0237 4.89551 6.53416 numMergedOcc 0
10 mol 279 unq 0 iso 0 dist 5.78017 8.03486 7.78018 4.91802 8.9352 8.34313 9.29922 13.4771 15.4124 7.17958 numMergedOcc 0
11 mol 279 unq 1 iso 0 dist 8.78203 8.03486 5.38411 4.91802 5.8845 8.34313 9.29922 12.7014 15.4124 7.17958 numMergedOcc 0
12 mol 292 unq 0 iso 0 dist 9.57857 5.83342 6.00343 7.60595 14.687 9.63325 13.9961 17.0154 12.0583 8.62162 numMergedOcc 0
