0 mol 10 unq 0 iso 0 dist 9.1125 14.7966 9.03951 16.1116 7.59547 5.99743 numMergedOcc 0
1 mol 67 unq 0 iso 0 dist 8.34804 4.31746 5.63802 13.4474 6.22963 9.67641 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 8.09675 7.25285 8.13535 12.3343 11.0045 7.80375 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 9.02753 5.90782 8.13535 13.3534 11.0045 7.80375 numMergedOcc 0
4 mol 75 unq 0 iso 0 dist 6.88616 6.71593 9.10622 12.7905 10.1921 9.3727 numMergedOcc 0
5 mol 79 unq 0 iso 0 dist 7.68781 4.22631 7.74901 6.96066 8.50961 4.3247 numMergedOcc 0
6 mol 124 unq 0 iso 0 dist 9.7589 11.2067 9.18949 18.9586 11.8195 9.87146 numMergedOcc 0
7 mol 147 unq 0 iso 0 dist 9.21476 7.38323 9.77522 12.3855 7.15931 8.89361 numMergedOcc 0
8 mol 185 unq 0 iso 0 dist 7.64068 6.26644 6.68054 12.923 8.43625 8.94849 numMergedOcc 0
9 mol 185 unq 1 iso 0 dist 7.64068 6.26644 6.68054 7.18997 6.35924 8.7695 numMergedOcc 0
10 mol 185 unq 2 iso 0 dist 9.83898 5.9439 6.68054 8.38127 8.43625 8.94849 numMergedOcc 0
11 mol 185 unq 3 iso 0 dist 9.83898 5.9439 6.68054 13.1417 6.35924 8.7695 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 8.32641 4.29967 9.2802 8.54588 4.70071 7.59836 numMergedOcc 0
13 mol 186 unq 1 iso 0 dist 8.32641 6.48822 7.2843 8.54588 4.70071 9.94274 numMergedOcc 0
14 mol 204 unq 0 iso 0 dist 4.45738 11.5701 8.82861 16.8504 13.6068 6.62013 numMergedOcc 0
15 mol 233 unq 0 iso 0 dist 8.20598 4.73615 9.83883 7.44436 5.33647 8.76329 numMergedOcc 0
16 mol 244 unq 0 iso 0 dist 9.53211 9.01951 9.97458 9.16789 8.64762 5.60146 numMergedOcc 0
17 mol 244 unq 1 iso 0 dist 9.53211 9.01951 9.97458 12.0298 18.0952 9.80249 numMergedOcc 0
18 mol 279 unq 0 iso 0 dist 9.56601 12.9629 9.29922 15.7634 12.3869 8.6522 numMergedOcc 0
19 mol 279 unq 1 iso 0 dist 9.56601 12.9629 9.29922 14.3216 7.27825 7.31529 numMergedOcc 0
20 mol 279 unq 2 iso 0 dist 9.56601 12.9629 9.29922 8.8643 4.77763 5.21664 numMergedOcc 0
21 mol 280 unq 0 iso 0 dist 7.78355 8.48093 8.47055 4.26671 6.12141 9.55885 numMergedOcc 0
