0 mol 18 unq 0 iso 0 dist 5.03976 8.35401 6.44368 10.3745 8.80193 7.60512 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 5.77643 5.51172 4.22398 4.4218 8.90835 6.88052 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 7.13638 8.26586 4.39445 4.35705 7.6481 7.58739 numMergedOcc 0
3 mol 58 unq 1 iso 0 dist 7.13638 9.76234 10.7557 4.35705 7.6481 9.01564 numMergedOcc 0
4 mol 64 unq 0 iso 0 dist 9.31622 8.12626 8.14214 12.7532 9.32552 15.4915 numMergedOcc 0
5 mol 79 unq 0 iso 0 dist 7.11013 8.52697 4.1859 12.6241 9.63599 9.77084 numMergedOcc 0
6 mol 79 unq 1 iso 0 dist 7.11013 9.66612 6.90535 12.6241 9.63599 13.4224 numMergedOcc 0
7 mol 85 unq 0 iso 0 dist 7.46478 6.24296 7.2898 4.32784 6.05495 5.05893 numMergedOcc 0
8 mol 85 unq 1 iso 0 dist 7.46478 6.83218 4.13305 4.32784 6.05495 5.71866 numMergedOcc 0
9 mol 134 unq 0 iso 0 dist 6.33375 9.13631 11.3936 11.528 6.21403 12.8357 numMergedOcc 0
10 mol 134 unq 1 iso 0 dist 8.06229 9.13631 13.7562 14.42 8.84087 19.184 numMergedOcc 0
11 mol 141 unq 0 iso 0 dist 6.96294 5.24228 6.37052 4.46354 5.52683 7.58337 numMergedOcc 0
12 mol 141 unq 1 iso 0 dist 7.1093 4.54218 4.22522 4.34943 5.26989 5.29898 numMergedOcc 0
13 mol 141 unq 2 iso 0 dist 7.1093 4.54218 4.22522 9.87387 7.76442 10.5285 numMergedOcc 0
14 mol 141 unq 3 iso 0 dist 7.36421 8.36316 4.22522 4.50791 5.26989 5.29898 numMergedOcc 0
15 mol 141 unq 4 iso 0 dist 7.36421 8.36316 4.22522 4.40308 7.76442 10.5285 numMergedOcc 0
16 mol 146 unq 0 iso 0 dist 9.39237 9.48545 5.93846 4.43511 6.50043 9.23136 numMergedOcc 0
17 mol 146 unq 1 iso 0 dist 9.39237 9.48545 5.93846 9.31627 9.44952 14.0401 numMergedOcc 0
18 mol 158 unq 0 iso 0 dist 7.63085 6.68721 9.88872 6.99918 9.6096 12.8033 numMergedOcc 0
19 mol 181 unq 0 iso 0 dist 7.82604 9.19831 5.08641 10.5886 5.95304 10.81 numMergedOcc 0
20 mol 181 unq 1 iso 0 dist 8.22583 9.19831 10.9122 6.15536 5.97685 8.59681 numMergedOcc 0
21 mol 181 unq 2 iso 0 dist 6.62037 7.83476 4.48306 4.19412 5.97685 8.12266 numMergedOcc 0
22 mol 181 unq 3 iso 0 dist 6.21461 7.83476 4.88823 4.19412 8.9289 8.12266 numMergedOcc 0
23 mol 184 unq 0 iso 0 dist 4.54491 8.90926 6.51384 6.01155 6.44904 10.3823 numMergedOcc 0
24 mol 225 unq 0 iso 0 dist 8.94219 7.9002 3.92979 16.3258 9.47117 10.7064 numMergedOcc 0
