0 mol 18 unq 0 iso 0 dist 9.4649 8.95573 10.3579 8.1366 16.059 16.833 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 6.45965 8.95573 5.867 8.1366 12.619 16.833 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 9.12062 5.73257 10.7494 6.20159 10.4051 7.48759 numMergedOcc 0
3 mol 70 unq 0 iso 0 dist 9.2794 8.06918 11.9871 9.54062 10.838 13.9104 numMergedOcc 0
4 mol 70 unq 1 iso 0 dist 9.2794 7.52623 9.5704 9.54062 10.838 14.6351 numMergedOcc 0
5 mol 70 unq 2 iso 0 dist 9.2794 5.62294 10.9277 9.54062 10.838 10.3843 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 7.32868 9.62702 4.47011 7.69672 5.71215 4.07654 numMergedOcc 0
7 mol 92 unq 1 iso 0 dist 7.32868 6.97484 11.9916 7.69672 5.71215 9.51614 numMergedOcc 0
8 mol 154 unq 0 iso 0 dist 9.71025 5.81632 6.28784 5.7306 10.3934 8.54747 numMergedOcc 0
9 mol 167 unq 0 iso 0 dist 9.08229 9.4422 10.9873 7.71402 11.7541 4.34476 numMergedOcc 0
10 mol 167 unq 1 iso 0 dist 9.08229 9.4422 10.9873 4.74768 7.86284 11.0292 numMergedOcc 0
11 mol 167 unq 2 iso 0 dist 7.99057 9.4422 12.2296 7.71402 13.2159 4.34476 numMergedOcc 0
12 mol 167 unq 3 iso 0 dist 7.99057 9.4422 12.2296 4.74768 3.81048 11.0292 numMergedOcc 0
13 mol 195 unq 0 iso 0 dist 8.51112 8.64561 5.86183 8.77346 8.93396 9.06228 numMergedOcc 0
14 mol 205 unq 0 iso 0 dist 8.95136 6.37411 15.2718 6.254 12.6877 6.30764 numMergedOcc 0
15 mol 260 unq 0 iso 0 dist 7.90537 9.50619 5.51525 6.57555 4.40935 5.92355 numMergedOcc 0
16 mol 277 unq 0 iso 0 dist 6.58667 9.28545 13.5948 7.89017 11.5085 6.90812 numMergedOcc 0
17 mol 277 unq 1 iso 0 dist 6.01542 9.28545 4.29127 7.89017 3.5373 6.90812 numMergedOcc 0
