0 mol 6 unq 0 iso 0 dist 9.46936 7.6948 5.72501 6.67429 13.0522 8.31647 numMergedOcc 0
1 mol 17 unq 0 iso 0 dist 7.30541 8.58468 5.67737 9.26114 11.4379 7.34681 numMergedOcc 0
2 mol 21 unq 0 iso 0 dist 9.19322 9.76497 12.26 5.38502 13.7087 8.6232 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 8.88399 9.08536 6.08168 16.6438 10.3917 7.69637 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 9.66461 7.99735 10.9256 13.11 8.66272 9.53081 numMergedOcc 0
5 mol 48 unq 1 iso 0 dist 8.81136 9.7516 10.9256 4.99432 8.66272 9.53081 numMergedOcc 0
6 mol 103 unq 0 iso 0 dist 9.24874 8.88177 7.75992 6.01015 11.0145 7.66418 numMergedOcc 0
7 mol 103 unq 1 iso 0 dist 9.24874 8.88177 7.75992 5.87263 12.5516 8.078 numMergedOcc 0
8 mol 103 unq 2 iso 0 dist 8.10965 9.42064 8.17578 9.45543 12.352 6.79959 numMergedOcc 0
9 mol 109 unq 0 iso 0 dist 7.39303 5.56645 8.55838 9.91621 12.8311 8.53914 numMergedOcc 0
10 mol 116 unq 0 iso 0 dist 8.49761 5.58346 6.80479 8.38134 12.3821 6.53824 numMergedOcc 0
11 mol 116 unq 1 iso 0 dist 8.49761 7.09179 6.42183 8.38134 12.3821 6.61973 numMergedOcc 0
12 mol 206 unq 0 iso 0 dist 9.95322 8.37024 10.2573 5.06545 12.3482 6.52136 numMergedOcc 0
13 mol 255 unq 0 iso 0 dist 5.84157 5.53395 4.03201 5.96376 7.20562 9.40767 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 8.88518 6.77021 14.8337 9.76099 16.9442 7.53199 numMergedOcc 0
15 mol 258 unq 1 iso 0 dist 8.88518 6.77021 14.8337 5.83092 13.4359 8.58092 numMergedOcc 0
16 mol 258 unq 2 iso 0 dist 8.88518 6.77021 14.8337 5.09024 11.6245 7.40014 numMergedOcc 0
17 mol 280 unq 0 iso 0 dist 7.61357 9.79817 16.4761 9.73214 17.1604 8.83076 numMergedOcc 0
18 mol 280 unq 1 iso 0 dist 7.61357 9.79817 16.4761 13.8226 19.2971 9.76967 numMergedOcc 0
19 mol 280 unq 2 iso 0 dist 7.31523 8.71581 15.4348 9.78493 15.456 8.83076 numMergedOcc 0
20 mol 280 unq 3 iso 0 dist 7.31523 8.71581 15.4348 7.74111 13.903 9.76967 numMergedOcc 0
21 mol 280 unq 4 iso 0 dist 8.67836 9.79817 15.4348 9.73214 15.456 8.83076 numMergedOcc 0
22 mol 280 unq 5 iso 0 dist 8.67836 9.79817 15.4348 13.8226 13.903 9.76967 numMergedOcc 0
23 mol 280 unq 6 iso 0 dist 7.60676 8.71581 13.219 9.78493 16.1963 8.83076 numMergedOcc 0
24 mol 280 unq 7 iso 0 dist 7.60676 8.71581 13.219 7.74111 6.88553 9.76967 numMergedOcc 0
