0 mol 1 unq 0 iso 0 dist 6.41817 11.6758 7.46399 11.7917 5.60534 9.02815 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 7.4868 7.52834 8.21384 10.1095 3.76267 9.66576 numMergedOcc 0
2 mol 37 unq 0 iso 0 dist 7.27697 10.3822 7.65758 14.1843 11.5334 9.25986 numMergedOcc 0
3 mol 61 unq 0 iso 0 dist 7.25041 6.27103 9.32664 9.72716 10.8154 8.30431 numMergedOcc 0
4 mol 100 unq 0 iso 0 dist 8.22984 11.2351 9.95103 17.0053 12.8792 7.11187 numMergedOcc 0
5 mol 100 unq 1 iso 0 dist 8.22984 11.2351 9.95103 9.52282 10.0156 6.60356 numMergedOcc 0
6 mol 100 unq 2 iso 0 dist 6.6157 8.46662 9.95103 14.4821 12.8792 7.11187 numMergedOcc 0
7 mol 100 unq 3 iso 0 dist 6.6157 8.46662 9.95103 10.1666 10.0156 6.60356 numMergedOcc 0
8 mol 100 unq 4 iso 0 dist 7.37771 10.5049 9.95103 15.2104 12.8792 7.11187 numMergedOcc 0
9 mol 100 unq 5 iso 0 dist 7.37771 10.5049 9.95103 13.9123 10.0156 6.60356 numMergedOcc 0
10 mol 167 unq 0 iso 0 dist 7.93807 10.8805 9.69399 6.6514 7.33075 9.82329 numMergedOcc 0
11 mol 184 unq 0 iso 0 dist 5.11863 3.95306 5.0207 9.39563 8.78943 9.45847 numMergedOcc 0
12 mol 184 unq 1 iso 0 dist 5.92785 9.14602 5.0207 7.51045 8.78943 9.45847 numMergedOcc 0
13 mol 189 unq 0 iso 0 dist 7.45329 6.58275 9.71563 9.07003 6.37312 7.04604 numMergedOcc 0
14 mol 189 unq 1 iso 0 dist 7.45329 6.58275 9.71563 9.71306 10.6364 5.11059 numMergedOcc 0
15 mol 192 unq 0 iso 0 dist 7.35424 8.0557 9.99783 9.67207 10.3343 7.30965 numMergedOcc 0
16 mol 214 unq 0 iso 0 dist 9.84034 12.1549 7.43301 14.5458 5.30923 7.25293 numMergedOcc 0
17 mol 214 unq 1 iso 0 dist 8.07237 9.59563 7.43301 12.6304 5.30923 7.25293 numMergedOcc 0
18 mol 214 unq 2 iso 0 dist 8.95218 6.52672 7.43301 5.12798 5.30923 7.25293 numMergedOcc 0
19 mol 227 unq 0 iso 0 dist 5.87056 9.22288 8.61546 9.09371 7.15779 5.2851 numMergedOcc 0
20 mol 227 unq 1 iso 0 dist 8.85568 9.22288 7.17024 9.09371 6.10844 5.2851 numMergedOcc 0
21 mol 227 unq 2 iso 0 dist 9.55881 10.3528 8.61546 13.2082 7.15779 5.2851 numMergedOcc 0
22 mol 249 unq 0 iso 0 dist 9.68308 13.3058 4.68783 15.0753 5.46606 4.46389 numMergedOcc 0
23 mol 260 unq 0 iso 0 dist 6.8795 5.75427 9.56846 9.94532 6.83989 8.13696 numMergedOcc 0
24 mol 279 unq 0 iso 0 dist 9.36891 10.1637 8.79637 5.00402 5.10287 9.98985 numMergedOcc 0
25 mol 279 unq 1 iso 0 dist 9.36891 5.61514 8.88458 5.00402 5.10287 7.22295 numMergedOcc 0
26 mol 279 unq 2 iso 0 dist 7.37358 10.6703 8.16582 18.3924 14.4524 8.78203 numMergedOcc 0
27 mol 287 unq 0 iso 0 dist 9.52718 15.6724 8.9316 15.9244 7.04567 8.04003 numMergedOcc 0
28 mol 288 unq 0 iso 0 dist 9.52718 15.6724 8.9316 15.9244 7.04567 8.04003 numMergedOcc 0
29 mol 289 unq 0 iso 0 dist 9.52718 15.6724 8.9316 15.9244 7.04567 8.04003 numMergedOcc 0
