0 mol 53 unq 0 iso 0 dist 7.72123 10.2172 6.95013 7.13301 8.79235 14.7368 numMergedOcc 0
1 mol 59 unq 0 iso 0 dist 7.35217 5.90159 9.53034 4.92632 9.56474 8.59585 numMergedOcc 0
2 mol 95 unq 0 iso 0 dist 9.18095 6.85756 7.15197 3.94084 5.99965 4.21171 numMergedOcc 0
3 mol 128 unq 0 iso 0 dist 8.20389 11.0542 7.50206 10.6485 5.23695 11.1981 numMergedOcc 0
4 mol 128 unq 1 iso 0 dist 8.20389 5.34549 6.4028 10.6485 5.23695 9.21247 numMergedOcc 0
5 mol 173 unq 0 iso 0 dist 8.87968 9.37181 4.0037 10.9596 6.95244 10.7636 numMergedOcc 0
6 mol 173 unq 1 iso 0 dist 8.87968 9.37181 4.0037 8.8578 6.11224 9.14584 numMergedOcc 0
7 mol 186 unq 0 iso 0 dist 8.72113 9.7478 5.67811 5.62911 9.77333 7.26749 numMergedOcc 0
8 mol 186 unq 1 iso 0 dist 8.72113 6.0273 8.74308 5.62911 9.77333 9.78272 numMergedOcc 0
9 mol 204 unq 0 iso 0 dist 7.30459 11.0308 9.42862 3.93117 5.81438 11.0735 numMergedOcc 0
10 mol 204 unq 1 iso 0 dist 8.73423 15.993 9.42862 11.1412 5.81438 11.0735 numMergedOcc 0
11 mol 214 unq 0 iso 0 dist 7.74406 11.1449 8.67237 7.96442 8.44407 8.18307 numMergedOcc 0
12 mol 214 unq 1 iso 0 dist 7.74406 11.1449 8.67237 3.87538 6.0155 10.8944 numMergedOcc 0
13 mol 214 unq 2 iso 0 dist 7.74406 11.1449 8.67237 11.5715 8.89981 13.1907 numMergedOcc 0
14 mol 214 unq 3 iso 0 dist 7.74406 6.71044 7.49436 7.96442 8.44407 12.2159 numMergedOcc 0
15 mol 214 unq 4 iso 0 dist 7.74406 6.71044 7.49436 3.87538 6.0155 8.87863 numMergedOcc 0
16 mol 214 unq 5 iso 0 dist 7.74406 6.71044 7.49436 11.5715 8.89981 5.52297 numMergedOcc 0
17 mol 251 unq 0 iso 0 dist 7.73217 8.44224 5.0953 4.66779 8.07576 9.29305 numMergedOcc 0
18 mol 266 unq 0 iso 0 dist 9.70632 7.90451 7.25797 6.11441 4.93584 3.34253 numMergedOcc 0
