0 mol 61 unq 0 iso 0 dist 7.52103 9.22002 6.86346 8.61908 8.46556 11.0419 numMergedOcc 0
1 mol 88 unq 0 iso 0 dist 7.74197 7.86537 5.57085 14.8895 9.72689 11.4004 numMergedOcc 0
2 mol 88 unq 1 iso 0 dist 7.74197 6.35462 9.94966 14.8895 9.72689 19.2119 numMergedOcc 0
3 mol 90 unq 0 iso 0 dist 5.9179 9.34782 7.60026 5.37245 9.44078 14.6132 numMergedOcc 0
4 mol 115 unq 0 iso 0 dist 7.95871 9.80286 12.5968 5.11161 4.98864 13.1665 numMergedOcc 0
5 mol 115 unq 1 iso 0 dist 9.80286 7.95871 12.5968 6.56935 6.48328 10.8398 numMergedOcc 0
6 mol 134 unq 0 iso 0 dist 9.92932 9.60411 5.49782 6.22325 9.55556 12.1043 numMergedOcc 0
7 mol 134 unq 1 iso 0 dist 9.55556 9.60369 5.62899 6.22325 9.92932 13.0095 numMergedOcc 0
8 mol 205 unq 0 iso 0 dist 5.4913 8.10287 9.33648 4.20051 6.752 12.1752 numMergedOcc 0
9 mol 206 unq 0 iso 0 dist 8.46319 9.36079 7.73294 5.6308 9.73892 13.9248 numMergedOcc 0
10 mol 206 unq 1 iso 0 dist 8.46319 9.36079 7.73294 3.85697 9.11298 7.42904 numMergedOcc 0
11 mol 206 unq 2 iso 0 dist 9.36079 8.46319 7.73294 3.85697 7.42904 9.11298 numMergedOcc 0
12 mol 206 unq 3 iso 0 dist 9.11298 7.42904 7.73294 8.70851 9.73892 13.9248 numMergedOcc 0
13 mol 206 unq 4 iso 0 dist 9.11298 7.42904 7.73294 3.85697 8.46319 9.36079 numMergedOcc 0
14 mol 206 unq 5 iso 0 dist 7.42904 9.11298 7.73294 3.85697 9.36079 8.46319 numMergedOcc 0
15 mol 236 unq 0 iso 0 dist 6.11137 7.89744 6.59448 5.26871 5.66569 9.48215 numMergedOcc 0
16 mol 236 unq 1 iso 0 dist 7.89744 6.11137 6.59448 8.96137 8.6417 12.6124 numMergedOcc 0
17 mol 237 unq 0 iso 0 dist 9.42743 9.5822 16.5066 15.4427 8.56463 21.6707 numMergedOcc 0
18 mol 277 unq 0 iso 0 dist 8.51931 8.96343 7.69449 13.7559 9.77689 17.2403 numMergedOcc 0
19 mol 292 unq 0 iso 0 dist 5.75596 9.11438 10.0122 13.4368 9.6898 19.1129 numMergedOcc 0
20 mol 292 unq 1 iso 0 dist 5.75596 8.37867 12.1693 13.4368 9.6898 20.8961 numMergedOcc 0
