0 mol 20 unq 0 iso 0 dist 8.7812 10.352 7.68085 9.76503 7.55864 4.49708 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 6.29578 10.352 8.45034 9.76503 9.33568 4.49708 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 4.82824 3.61874 7.70787 5.93093 6.00779 9.42024 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 9.46867 13.7144 9.57191 6.28936 5.52283 10.3721 numMergedOcc 0
4 mol 120 unq 0 iso 0 dist 9.17864 9.43335 6.84082 8.27934 7.48283 6.87017 numMergedOcc 0
5 mol 120 unq 1 iso 0 dist 9.17864 9.71207 8.66256 8.27934 7.48283 10.0173 numMergedOcc 0
6 mol 120 unq 2 iso 0 dist 9.17864 12.1938 8.08194 8.27934 7.48283 5.23504 numMergedOcc 0
7 mol 120 unq 3 iso 0 dist 9.17864 16.9923 9.89622 8.27934 7.48283 12.6234 numMergedOcc 0
8 mol 120 unq 4 iso 0 dist 9.39373 6.90523 6.84082 10.5358 7.48283 6.87017 numMergedOcc 0
9 mol 120 unq 5 iso 0 dist 9.39373 4.81408 8.66256 10.5358 7.48283 10.0173 numMergedOcc 0
10 mol 120 unq 6 iso 0 dist 9.39373 11.8812 8.08194 10.5358 7.48283 5.23504 numMergedOcc 0
11 mol 120 unq 7 iso 0 dist 9.39373 14.0826 9.89622 10.5358 7.48283 12.6234 numMergedOcc 0
12 mol 125 unq 0 iso 0 dist 7.7203 13.1097 9.87276 4.65908 8.04452 10.3921 numMergedOcc 0
13 mol 125 unq 1 iso 0 dist 7.7203 4.18521 9.97204 4.65908 8.04452 5.36325 numMergedOcc 0
14 mol 132 unq 0 iso 0 dist 9.90511 8.89056 8.31873 5.64836 5.69956 4.56231 numMergedOcc 0
15 mol 214 unq 0 iso 0 dist 9.46363 10.534 9.05875 11.4312 5.10016 11.0048 numMergedOcc 0
16 mol 219 unq 0 iso 0 dist 9.72263 9.58042 8.15287 12.4335 6.65093 6.90398 numMergedOcc 0
17 mol 219 unq 1 iso 0 dist 9.72263 9.58042 8.15287 13.4956 9.93514 15.4761 numMergedOcc 0
18 mol 219 unq 2 iso 0 dist 9.72263 12.8131 8.72341 12.4335 6.65093 14.8716 numMergedOcc 0
19 mol 219 unq 3 iso 0 dist 9.72263 12.8131 8.72341 13.4956 9.93514 6.78678 numMergedOcc 0
20 mol 219 unq 4 iso 0 dist 9.65487 13.0508 8.15287 12.6746 6.65093 6.90398 numMergedOcc 0
21 mol 219 unq 5 iso 0 dist 9.65487 13.0508 8.15287 13.8617 9.93514 15.4761 numMergedOcc 0
22 mol 219 unq 6 iso 0 dist 9.65487 10.1996 8.72341 12.6746 6.65093 14.8716 numMergedOcc 0
23 mol 219 unq 7 iso 0 dist 9.65487 10.1996 8.72341 13.8617 9.93514 6.78678 numMergedOcc 0
24 mol 242 unq 0 iso 0 dist 9.84875 12.6596 8.75712 11.8419 8.90437 9.37076 numMergedOcc 0
25 mol 247 unq 0 iso 0 dist 9.90771 4.38981 5.89063 13.2112 6.50869 8.96314 numMergedOcc 0
26 mol 247 unq 1 iso 0 dist 9.90771 4.38981 5.89063 7.25767 9.54682 5.39204 numMergedOcc 0
27 mol 251 unq 0 iso 0 dist 9.31994 12.3736 6.32455 8.97824 8.63134 12.1353 numMergedOcc 0
28 mol 251 unq 1 iso 0 dist 4.63025 6.87139 6.32455 12.3076 8.63134 12.1353 numMergedOcc 0
29 mol 259 unq 0 iso 0 dist 8.14345 5.0262 4.98888 6.9617 8.14526 5.45575 numMergedOcc 0
30 mol 259 unq 1 iso 0 dist 8.14345 5.0262 4.98888 6.41332 7.75803 7.04297 numMergedOcc 0
31 mol 259 unq 2 iso 0 dist 8.14345 5.0262 4.98888 7.10065 7.94491 6.13878 numMergedOcc 0
