0 mol 44 unq 0 iso 0 dist 9.03899 9.26518 4.94258 8.12125 9.16411 10.731 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 5.99047 4.9983 6.89433 8.75627 6.4776 12.1038 numMergedOcc 0
2 mol 109 unq 0 iso 0 dist 8.17621 8.85675 4.37072 6.64941 8.80233 12.0623 numMergedOcc 0
3 mol 109 unq 1 iso 0 dist 8.17621 8.85675 4.37072 4.89837 8.71813 9.67274 numMergedOcc 0
4 mol 172 unq 0 iso 0 dist 6.10845 9.99358 3.99017 7.38149 8.32997 11.4471 numMergedOcc 0
5 mol 176 unq 0 iso 0 dist 7.93501 9.81999 6.78421 7.93175 9.78837 14.1583 numMergedOcc 0
6 mol 176 unq 1 iso 0 dist 7.93501 8.89489 9.33063 7.93175 9.78837 12.2795 numMergedOcc 0
7 mol 186 unq 0 iso 0 dist 5.82681 8.86574 5.28021 7.72772 7.95201 8.46395 numMergedOcc 0
8 mol 186 unq 1 iso 0 dist 5.82681 8.86574 5.28021 10.0766 9.39908 6.08596 numMergedOcc 0
9 mol 226 unq 0 iso 0 dist 9.45587 7.4717 13.0829 9.05386 7.8941 15.825 numMergedOcc 0
10 mol 235 unq 0 iso 0 dist 9.07461 5.49475 6.74741 6.49782 9.49829 10.0126 numMergedOcc 0
11 mol 257 unq 0 iso 0 dist 6.11188 6.73777 3.67174 9.817 9.51692 6.11157 numMergedOcc 0
12 mol 257 unq 1 iso 0 dist 6.11188 9.04664 4.76602 9.817 9.51692 8.97744 numMergedOcc 0
13 mol 260 unq 0 iso 0 dist 8.88803 8.90109 13.0341 9.39438 7.30709 12.6218 numMergedOcc 0
14 mol 281 unq 0 iso 0 dist 5.0007 7.8046 12.4082 8.25337 9.76311 13.2977 numMergedOcc 0
