0 mol 44 unq 0 iso 0 dist 8.72535 12.7874 7.85573 18.3112 10.1746 9.53901 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 8.99557 9.89704 8.55031 11.7226 11.9729 8.16059 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 9.05165 8.77048 7.40694 13.1927 5.28198 7.99399 numMergedOcc 0
3 mol 61 unq 0 iso 0 dist 9.27499 12.4095 9.67403 15.8076 16.6923 9.94756 numMergedOcc 0
4 mol 74 unq 0 iso 0 dist 7.15667 5.45141 9.80207 9.67265 7.11496 9.50176 numMergedOcc 0
5 mol 83 unq 0 iso 0 dist 9.56049 4.21416 8.95808 6.98288 5.86285 7.78306 numMergedOcc 0
6 mol 117 unq 0 iso 0 dist 9.31914 10.1282 6.81489 13.4483 5.76817 5.24519 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 9.52341 9.44398 8.39253 14.4734 7.49885 7.26463 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 8.75007 16.1672 9.63488 15.6941 7.55155 6.89564 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 6.52227 5.49686 6.95914 5.77703 3.80626 8.51265 numMergedOcc 0
10 mol 148 unq 0 iso 0 dist 7.6395 4.23703 9.53814 6.18528 6.07309 5.34451 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 8.67838 6.18164 4.96259 6.63046 6.6215 5.77393 numMergedOcc 0
12 mol 252 unq 0 iso 0 dist 6.68688 6.68415 8.63848 5.42327 9.75362 7.74647 numMergedOcc 0
