0 mol 43 unq 0 iso 0 dist 6.35333 9.79432 9.15042 5.97717 9.18371 10.9303 numMergedOcc 0
1 mol 43 unq 1 iso 0 dist 9.16277 10.2669 9.15042 5.63651 9.18371 10.9303 numMergedOcc 0
2 mol 89 unq 0 iso 0 dist 8.85873 8.12715 8.25651 11.2532 6.36021 7.94744 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 9.8079 5.84297 5.89394 11.4622 4.98104 5.73112 numMergedOcc 0
4 mol 92 unq 1 iso 0 dist 8.3558 11.0794 5.89394 5.38868 4.98104 5.73112 numMergedOcc 0
5 mol 110 unq 0 iso 0 dist 7.77678 6.88366 6.59361 11.5698 5.25492 6.82715 numMergedOcc 0
6 mol 114 unq 0 iso 0 dist 6.71345 8.20626 5.87387 5.67441 8.42445 5.6579 numMergedOcc 0
7 mol 122 unq 0 iso 0 dist 8.47907 9.39204 5.09114 6.85647 8.33083 12.2043 numMergedOcc 0
8 mol 176 unq 0 iso 0 dist 8.78509 7.52069 4.96326 12.526 9.03194 12.8098 numMergedOcc 0
9 mol 176 unq 1 iso 0 dist 8.78509 7.54492 9.09976 12.526 9.03194 6.31058 numMergedOcc 0
10 mol 176 unq 2 iso 0 dist 8.78509 6.99149 9.73567 12.526 9.03194 9.26882 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 9.74465 8.11056 6.07676 5.02351 7.44191 5.90964 numMergedOcc 0
12 mol 181 unq 1 iso 0 dist 9.74465 8.11056 6.07676 12.774 6.00053 6.18164 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 9.52413 12.5521 5.63906 4.62432 7.66381 9.72967 numMergedOcc 0
14 mol 213 unq 0 iso 0 dist 9.73691 5.88456 6.82881 11.0017 4.58599 10.3239 numMergedOcc 0
15 mol 213 unq 1 iso 0 dist 9.73691 5.88456 6.82881 10.4464 8.78568 11.0972 numMergedOcc 0
16 mol 238 unq 0 iso 0 dist 9.39537 8.99495 9.82174 6.39493 9.75174 10.7991 numMergedOcc 0
17 mol 284 unq 0 iso 0 dist 9.98268 16.0227 9.27402 8.92414 8.27793 17.2173 numMergedOcc 0
