0 mol 6 unq 0 iso 0 dist 7.13004 9.67225 9.15194 10.725 4.26359 9.1538 numMergedOcc 0
1 mol 6 unq 1 iso 0 dist 7.13004 13.1814 7.74208 10.725 4.26359 7.46244 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 5.46378 4.44274 9.36326 4.71964 7.1845 8.26412 numMergedOcc 0
3 mol 25 unq 1 iso 0 dist 5.46378 4.44274 9.36326 6.58478 9.01438 8.94262 numMergedOcc 0
4 mol 32 unq 0 iso 0 dist 4.31912 11.3409 9.5209 9.16481 6.49199 7.48994 numMergedOcc 0
5 mol 34 unq 0 iso 0 dist 6.57908 5.15167 5.77643 7.61802 4.22398 5.51172 numMergedOcc 0
6 mol 34 unq 1 iso 0 dist 6.31824 7.4142 8.8197 8.87762 4.53851 7.93454 numMergedOcc 0
7 mol 34 unq 2 iso 0 dist 6.31824 7.4142 8.8197 8.21762 5.31195 9.06898 numMergedOcc 0
8 mol 74 unq 0 iso 0 dist 9.9058 4.33247 8.47441 10.324 5.06304 7.0427 numMergedOcc 0
9 mol 79 unq 0 iso 0 dist 8.20851 4.90344 9.62096 13.2673 17.0218 8.52697 numMergedOcc 0
10 mol 79 unq 1 iso 0 dist 8.20851 4.90344 9.62096 14.5591 16.4359 9.66612 numMergedOcc 0
11 mol 79 unq 2 iso 0 dist 8.91063 4.90344 7.93317 13.2673 13.5391 8.52697 numMergedOcc 0
12 mol 79 unq 3 iso 0 dist 8.91063 4.90344 7.93317 14.5591 12.6233 9.66612 numMergedOcc 0
13 mol 117 unq 0 iso 0 dist 6.96357 4.87865 9.0428 9.57343 13.3894 5.20001 numMergedOcc 0
14 mol 141 unq 0 iso 0 dist 8.82363 11.6204 6.96294 11.438 6.37052 5.24228 numMergedOcc 0
15 mol 141 unq 1 iso 0 dist 5.76702 7.37698 6.96294 6.31404 6.37052 5.24228 numMergedOcc 0
16 mol 225 unq 0 iso 0 dist 4.90724 5.47022 8.94219 6.20862 3.92979 7.9002 numMergedOcc 0
17 mol 225 unq 1 iso 0 dist 7.01671 9.24981 8.94219 10.0037 3.92979 7.9002 numMergedOcc 0
18 mol 233 unq 0 iso 0 dist 9.13657 5.09438 7.40764 7.79426 6.80416 9.79864 numMergedOcc 0
19 mol 266 unq 0 iso 0 dist 8.93824 6.68601 5.60932 8.6959 4.41057 7.81168 numMergedOcc 0
