0 mol 10 unq 0 iso 0 dist 8.44864 5.94361 5.59965 13.4422 12.4032 9.39017 numMergedOcc 0
1 mol 15 unq 0 iso 0 dist 5.19544 8.80394 6.03257 10.8364 7.49229 8.3794 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 9.27369 12.8556 6.93197 14.706 6.76331 5.56687 numMergedOcc 0
3 mol 91 unq 0 iso 0 dist 5.51406 10.4949 8.66165 9.63646 5.06999 7.12701 numMergedOcc 0
4 mol 114 unq 0 iso 0 dist 8.27794 14.0508 8.42878 15.0895 9.72019 9.58855 numMergedOcc 0
5 mol 114 unq 1 iso 0 dist 7.48533 3.88006 8.42878 5.82456 5.78064 8.55826 numMergedOcc 0
6 mol 116 unq 0 iso 0 dist 7.6005 10.5065 8.38606 16.5838 10.5909 8.3971 numMergedOcc 0
7 mol 116 unq 1 iso 0 dist 7.6005 10.5065 8.38606 12.4936 6.2875 6.74026 numMergedOcc 0
8 mol 116 unq 2 iso 0 dist 8.7583 14.2962 8.38606 19.124 10.5909 8.3971 numMergedOcc 0
9 mol 116 unq 3 iso 0 dist 8.7583 14.2962 8.38606 14.7718 6.2875 6.74026 numMergedOcc 0
10 mol 171 unq 0 iso 0 dist 6.21194 4.47323 5.25109 10.1182 5.66419 8.29782 numMergedOcc 0
11 mol 171 unq 1 iso 0 dist 6.21194 4.73373 8.21618 11.9664 13.5731 7.61144 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 7.58256 5.98598 6.21159 11.8242 4.93748 8.53237 numMergedOcc 0
13 mol 186 unq 1 iso 0 dist 7.58256 5.98598 6.21159 7.81904 4.78938 4.65126 numMergedOcc 0
14 mol 226 unq 0 iso 0 dist 7.04477 11.378 5.70795 10.7844 4.66376 6.45143 numMergedOcc 0
15 mol 238 unq 0 iso 0 dist 7.26887 6.5335 5.92374 9.91128 4.04422 6.80544 numMergedOcc 0
16 mol 247 unq 0 iso 0 dist 6.18065 10.7268 8.45756 11.1563 5.07285 8.54404 numMergedOcc 0
