0 mol 79 unq 0 iso 0 dist 7.11013 6.9297 6.49291 12.6241 9.63599 9.78384 numMergedOcc 0
1 mol 85 unq 0 iso 0 dist 7.46478 5.99046 13.3263 4.32784 6.05495 9.66222 numMergedOcc 0
2 mol 128 unq 0 iso 0 dist 5.89919 8.15593 3.98036 5.41268 7.75012 7.48321 numMergedOcc 0
3 mol 128 unq 1 iso 0 dist 5.89919 8.15593 3.98036 6.06511 6.98158 10.8772 numMergedOcc 0
4 mol 141 unq 0 iso 0 dist 7.6461 7.57714 5.39904 9.90045 5.26989 10.3566 numMergedOcc 0
5 mol 141 unq 1 iso 0 dist 7.6461 7.57714 5.39904 10.0807 7.76442 9.93907 numMergedOcc 0
6 mol 156 unq 0 iso 0 dist 7.08808 6.29351 5.69209 5.57422 7.30946 5.41575 numMergedOcc 0
7 mol 181 unq 0 iso 0 dist 7.82604 5.87853 6.27947 10.5886 5.95304 10.515 numMergedOcc 0
8 mol 181 unq 1 iso 0 dist 8.22583 5.87853 11.2039 6.15536 5.97685 7.22883 numMergedOcc 0
9 mol 181 unq 2 iso 0 dist 6.62037 8.83185 8.93991 4.19412 5.97685 10.3104 numMergedOcc 0
10 mol 181 unq 3 iso 0 dist 6.21461 8.83185 5.35588 4.19412 8.9289 10.3104 numMergedOcc 0
11 mol 184 unq 0 iso 0 dist 4.54491 9.13228 7.43402 6.01155 6.44904 10.95 numMergedOcc 0
12 mol 235 unq 0 iso 0 dist 7.79898 9.22128 13.128 9.28045 7.31773 17.8712 numMergedOcc 0
13 mol 267 unq 0 iso 0 dist 9.18446 8.22601 11.5479 6.18902 9.01354 13.8549 numMergedOcc 0
14 mol 267 unq 1 iso 0 dist 9.18446 6.55433 10.0939 6.18902 9.01354 9.49204 numMergedOcc 0
15 mol 271 unq 0 iso 0 dist 6.71956 6.70662 4.51983 4.91325 5.81266 5.92274 numMergedOcc 0
