0 mol 54 unq 0 iso 0 dist 8.66233 14.5556 5.97635 15.5496 9.88291 9.5915 numMergedOcc 0
1 mol 54 unq 1 iso 0 dist 5.88766 9.99915 5.97635 7.12744 9.88291 9.5915 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 8.3906 12.2156 6.65344 9.87071 5.34079 4.67917 numMergedOcc 0
3 mol 59 unq 1 iso 0 dist 8.3906 12.2156 6.65344 12.3204 6.11334 6.88924 numMergedOcc 0
4 mol 78 unq 0 iso 0 dist 8.44427 5.46827 9.23023 11.7397 7.17843 9.84346 numMergedOcc 0
5 mol 78 unq 1 iso 0 dist 8.44427 5.46827 9.23023 10.9749 4.4651 9.46472 numMergedOcc 0
6 mol 120 unq 0 iso 0 dist 6.68587 7.66137 7.04864 10.7652 5.89379 8.43293 numMergedOcc 0
7 mol 127 unq 0 iso 0 dist 4.84594 6.26588 9.42513 6.33673 4.70935 9.16999 numMergedOcc 0
8 mol 176 unq 0 iso 0 dist 8.55939 7.34694 9.66407 10.688 6.1294 9.94201 numMergedOcc 0
9 mol 180 unq 0 iso 0 dist 7.73514 9.02836 7.1027 11.8153 4.28574 8.39718 numMergedOcc 0
10 mol 237 unq 0 iso 0 dist 9.88189 18.6757 9.42743 21.8703 15.4677 9.18638 numMergedOcc 0
11 mol 237 unq 1 iso 0 dist 4.78488 4.92064 9.42743 12.3326 15.4677 9.18638 numMergedOcc 0
12 mol 251 unq 0 iso 0 dist 7.2365 6.16781 7.4878 9.75041 8.64172 8.89433 numMergedOcc 0
13 mol 259 unq 0 iso 0 dist 9.36119 5.81751 6.42725 10.1994 5.59901 5.30455 numMergedOcc 0
14 mol 259 unq 1 iso 0 dist 9.36119 5.81751 6.42725 11.6318 4.30432 6.8184 numMergedOcc 0
15 mol 273 unq 0 iso 0 dist 9.54195 11.5561 8.57501 10.6668 4.50319 8.65593 numMergedOcc 0
