0 mol 54 unq 0 iso 0 dist 6.50287 6.46263 5.38429 7.18148 6.10172 10.3901 numMergedOcc 0
1 mol 69 unq 0 iso 0 dist 5.3931 8.61203 10.0484 7.07055 3.69583 7.7289 numMergedOcc 0
2 mol 83 unq 0 iso 0 dist 6.83169 9.54935 11.2044 6.72584 7.20975 6.46071 numMergedOcc 0
3 mol 83 unq 1 iso 0 dist 6.83169 9.54935 11.2044 7.25594 11.1065 3.96895 numMergedOcc 0
4 mol 83 unq 2 iso 0 dist 8.92911 9.54935 10.0014 6.72584 7.44689 6.46071 numMergedOcc 0
5 mol 83 unq 3 iso 0 dist 8.92911 9.54935 10.0014 7.25594 11.1318 3.96895 numMergedOcc 0
6 mol 83 unq 4 iso 0 dist 8.07172 9.54935 12.5113 6.72584 11.7887 6.46071 numMergedOcc 0
7 mol 83 unq 5 iso 0 dist 8.07172 9.54935 12.5113 7.25594 12.5763 3.96895 numMergedOcc 0
8 mol 83 unq 6 iso 0 dist 7.8627 9.54935 9.37182 6.72584 11.0783 6.46071 numMergedOcc 0
9 mol 83 unq 7 iso 0 dist 7.8627 9.54935 9.37182 7.25594 6.48431 3.96895 numMergedOcc 0
10 mol 91 unq 0 iso 0 dist 6.17698 9.23907 7.45052 8.47126 7.53537 9.46631 numMergedOcc 0
11 mol 103 unq 0 iso 0 dist 5.09936 9.66944 10.591 7.85115 5.99213 15.8357 numMergedOcc 0
12 mol 167 unq 0 iso 0 dist 5.36359 7.62006 6.25478 7.33483 4.0116 3.85621 numMergedOcc 0
13 mol 249 unq 0 iso 0 dist 9.87896 8.84212 12.6492 6.32658 11.6107 4.76162 numMergedOcc 0
14 mol 249 unq 1 iso 0 dist 9.87896 7.10933 9.85936 6.32658 11.6107 3.89698 numMergedOcc 0
15 mol 284 unq 0 iso 0 dist 9.40824 7.41633 14.126 4.69611 10.676 5.88619 numMergedOcc 0
16 mol 284 unq 1 iso 0 dist 9.40824 5.52837 9.97226 4.69611 10.676 4.57529 numMergedOcc 0
17 mol 284 unq 2 iso 0 dist 9.40824 6.73163 6.31116 4.69611 10.676 5.2614 numMergedOcc 0
18 mol 284 unq 3 iso 0 dist 6.1324 7.41633 12.8898 4.69611 8.82223 5.88619 numMergedOcc 0
19 mol 284 unq 4 iso 0 dist 6.1324 5.52837 9.53375 4.69611 8.82223 4.57529 numMergedOcc 0
20 mol 284 unq 5 iso 0 dist 6.1324 6.73163 7.08296 4.69611 8.82223 5.2614 numMergedOcc 0
21 mol 287 unq 0 iso 0 dist 7.39418 7.26294 8.71837 6.17759 4.73745 4.13973 numMergedOcc 0
22 mol 287 unq 1 iso 0 dist 7.39418 7.26294 8.71837 8.20391 4.16431 7.1669 numMergedOcc 0
23 mol 288 unq 0 iso 0 dist 7.39418 7.26294 8.71837 6.17759 4.73745 4.13973 numMergedOcc 0
24 mol 288 unq 1 iso 0 dist 7.39418 7.26294 8.71837 8.20391 4.16431 7.1669 numMergedOcc 0
25 mol 289 unq 0 iso 0 dist 7.39418 7.26294 8.71837 6.17759 4.73745 4.13973 numMergedOcc 0
26 mol 289 unq 1 iso 0 dist 7.39418 7.26294 8.71837 8.20391 4.16431 7.1669 numMergedOcc 0
