0 mol 37 unq 0 iso 0 dist 8.40835 13.4556 9.25986 14.502 11.5334 7.65758 numMergedOcc 0
1 mol 61 unq 0 iso 0 dist 9.72716 6.27103 8.30431 7.25041 10.8154 9.32664 numMergedOcc 0
2 mol 69 unq 0 iso 0 dist 8.44753 6.88345 3.87167 15.5809 7.14194 9.99691 numMergedOcc 0
3 mol 100 unq 0 iso 0 dist 9.52282 11.2351 6.60356 8.22984 10.0156 9.95103 numMergedOcc 0
4 mol 129 unq 0 iso 0 dist 7.48833 13.4277 8.34427 11.5412 5.9261 9.86237 numMergedOcc 0
5 mol 167 unq 0 iso 0 dist 6.6514 10.8805 9.82329 7.93807 7.33075 9.69399 numMergedOcc 0
6 mol 184 unq 0 iso 0 dist 9.0757 16.3549 9.45847 14.0296 8.78943 5.0207 numMergedOcc 0
7 mol 184 unq 1 iso 0 dist 9.39563 3.95306 9.45847 5.11863 8.78943 5.0207 numMergedOcc 0
8 mol 184 unq 2 iso 0 dist 7.51045 9.14602 9.45847 5.92785 8.78943 5.0207 numMergedOcc 0
9 mol 189 unq 0 iso 0 dist 9.71306 6.58275 5.11059 7.45329 10.6364 9.71563 numMergedOcc 0
10 mol 192 unq 0 iso 0 dist 9.67207 8.0557 7.30965 16.7684 11.0867 8.96522 numMergedOcc 0
11 mol 192 unq 1 iso 0 dist 9.67207 8.0557 7.30965 12.73 8.67274 7.04366 numMergedOcc 0
12 mol 192 unq 2 iso 0 dist 9.67207 8.0557 7.30965 7.35424 10.3343 9.99783 numMergedOcc 0
13 mol 214 unq 0 iso 0 dist 5.12798 6.52672 7.25293 8.95218 5.30923 7.43301 numMergedOcc 0
14 mol 227 unq 0 iso 0 dist 9.09371 9.22288 5.2851 5.87056 7.15779 8.61546 numMergedOcc 0
15 mol 227 unq 1 iso 0 dist 9.09371 9.22288 5.2851 8.85568 6.10844 7.17024 numMergedOcc 0
16 mol 259 unq 0 iso 0 dist 9.73735 5.48962 8.73077 11.226 11.4974 9.69025 numMergedOcc 0
17 mol 259 unq 1 iso 0 dist 6.6238 5.48962 6.76656 11.226 7.39099 9.69025 numMergedOcc 0
18 mol 260 unq 0 iso 0 dist 9.94532 5.75427 8.13696 6.8795 6.83989 9.56846 numMergedOcc 0
19 mol 279 unq 0 iso 0 dist 5.00402 10.1637 9.98985 11.6018 10.2995 6.12347 numMergedOcc 0
20 mol 279 unq 1 iso 0 dist 5.00402 10.1637 9.98985 9.36891 5.10287 8.79637 numMergedOcc 0
21 mol 279 unq 2 iso 0 dist 5.00402 5.61514 7.22295 9.36891 5.10287 8.88458 numMergedOcc 0
