0 mol 11 unq 0 iso 0 dist 9.42607 6.20956 6.79033 10.4181 9.52695 10.6838 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 9.30547 6.46901 6.97513 13.4254 9.27409 15.0422 numMergedOcc 0
2 mol 92 unq 0 iso 0 dist 6.39759 8.03407 4.13723 10.2731 9.18898 13.0999 numMergedOcc 0
3 mol 92 unq 1 iso 0 dist 6.39759 8.03407 4.13723 4.66752 7.67331 10.7591 numMergedOcc 0
4 mol 98 unq 0 iso 0 dist 6.17173 9.22411 9.44223 5.91879 8.41411 11.3756 numMergedOcc 0
5 mol 100 unq 0 iso 0 dist 7.11556 6.15185 4.01481 10.516 9.16592 11.8465 numMergedOcc 0
6 mol 103 unq 0 iso 0 dist 5.7953 9.71805 8.84187 5.95263 5.78029 13.4235 numMergedOcc 0
7 mol 103 unq 1 iso 0 dist 5.7953 4.9418 7.44304 5.95263 5.78029 10.1035 numMergedOcc 0
8 mol 128 unq 0 iso 0 dist 5.32517 7.6275 3.57533 5.8344 8.87314 10.2256 numMergedOcc 0
9 mol 128 unq 1 iso 0 dist 5.32517 7.4738 10.0842 5.8344 8.87314 12.5952 numMergedOcc 0
10 mol 128 unq 2 iso 0 dist 5.32517 8.88867 11.7069 5.8344 8.87314 9.49761 numMergedOcc 0
11 mol 128 unq 3 iso 0 dist 5.32517 7.04282 8.45681 5.8344 8.87314 9.38436 numMergedOcc 0
12 mol 128 unq 4 iso 0 dist 8.88867 5.32517 11.7069 5.8344 9.49761 8.87314 numMergedOcc 0
13 mol 128 unq 5 iso 0 dist 8.88867 5.32517 11.7069 10.172 6.03154 14.8285 numMergedOcc 0
14 mol 128 unq 6 iso 0 dist 8.88867 7.6275 11.0489 5.8344 9.49761 10.2256 numMergedOcc 0
15 mol 128 unq 7 iso 0 dist 8.88867 7.6275 11.0489 10.172 6.03154 15.4399 numMergedOcc 0
16 mol 128 unq 8 iso 0 dist 8.88867 7.4738 9.43368 5.8344 9.49761 12.5952 numMergedOcc 0
17 mol 128 unq 9 iso 0 dist 8.88867 7.4738 9.43368 10.172 6.03154 10.3883 numMergedOcc 0
18 mol 128 unq 10 iso 0 dist 8.88867 7.04282 3.93975 5.8344 9.49761 9.38436 numMergedOcc 0
19 mol 128 unq 11 iso 0 dist 8.88867 7.04282 3.93975 10.172 6.03154 9.03339 numMergedOcc 0
20 mol 128 unq 12 iso 0 dist 7.04282 5.32517 8.45681 5.8344 9.38436 8.87314 numMergedOcc 0
21 mol 128 unq 13 iso 0 dist 7.04282 7.6275 7.50392 5.8344 9.38436 10.2256 numMergedOcc 0
22 mol 128 unq 14 iso 0 dist 7.04282 7.4738 7.72018 5.8344 9.38436 12.5952 numMergedOcc 0
23 mol 128 unq 15 iso 0 dist 7.04282 8.88867 3.93975 5.8344 9.38436 9.49761 numMergedOcc 0
24 mol 141 unq 0 iso 0 dist 8.47476 6.74947 15.1471 14.894 7.6793 20.9125 numMergedOcc 0
25 mol 141 unq 1 iso 0 dist 6.74947 8.47476 15.1471 10.7523 8.01453 17.8576 numMergedOcc 0
26 mol 204 unq 0 iso 0 dist 5.29176 6.32064 3.78668 9.11934 8.62191 11.7905 numMergedOcc 0
27 mol 223 unq 0 iso 0 dist 7.30699 9.5073 4.00983 6.34447 7.81769 7.66694 numMergedOcc 0
28 mol 223 unq 1 iso 0 dist 9.5073 7.30699 4.00983 6.34447 7.66694 7.81769 numMergedOcc 0
29 mol 260 unq 0 iso 0 dist 7.46 6.71406 5.43735 8.565 5.68717 10.4213 numMergedOcc 0
