0 mol 26 unq 0 iso 0 dist 7.7868 5.19508 7.61055 4.03003 7.3022 5.30297 11.3806 10.1809 6.73259 9.27369 numMergedOcc 0
1 mol 41 unq 0 iso 0 dist 8.91418 4.15148 5.52067 6.78868 6.73801 6.32189 9.59131 5.14132 8.19484 5.31016 numMergedOcc 0
2 mol 41 unq 1 iso 0 dist 6.0961 7.51317 5.52067 12.0084 6.73801 6.32189 10.2426 5.14132 8.19484 5.31016 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 8.84323 5.0413 9.87677 7.46975 6.04903 7.97193 15.5808 12.1095 14.8527 8.2746 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 7.57958 7.38289 9.28578 12.656 5.39745 12.1199 14.9666 10.4617 16.8733 9.18898 numMergedOcc 0
5 mol 114 unq 0 iso 0 dist 7.50886 7.3539 8.11094 5.21101 9.83981 11.4429 8.53731 8.32999 14.2539 8.27794 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 8.95838 7.58689 9.05798 12.2067 7.26955 7.34151 11.3476 6.02826 12.0395 8.4733 numMergedOcc 0
7 mol 119 unq 1 iso 0 dist 8.95838 5.47002 5.85818 12.2067 7.26955 11.7884 11.3476 6.02826 10.1992 8.4733 numMergedOcc 0
8 mol 119 unq 2 iso 0 dist 9.47892 9.21153 9.05798 4.09788 7.26955 7.34151 11.8884 6.02826 12.0395 8.4733 numMergedOcc 0
9 mol 119 unq 3 iso 0 dist 9.47892 13.8865 5.85818 4.09788 7.26955 11.7884 11.8884 6.02826 10.1992 8.4733 numMergedOcc 0
10 mol 146 unq 0 iso 0 dist 9.77771 13.2483 8.68349 11.2713 9.44952 6.00811 14.6165 10.9218 11.4102 7.13378 numMergedOcc 0
11 mol 173 unq 0 iso 0 dist 9.56248 13.638 7.54706 7.6477 8.41245 9.77146 10.4088 10.5012 16.2888 9.38737 numMergedOcc 0
12 mol 173 unq 1 iso 0 dist 9.56248 13.638 7.54706 5.04427 6.64779 9.43677 10.0903 12.905 17.5341 9.51638 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 9.70025 8.93412 7.96291 6.02828 8.9289 6.12563 15.0055 12.5567 9.91705 9.07527 numMergedOcc 0
14 mol 273 unq 0 iso 0 dist 9.79283 5.62645 6.94131 13.9497 8.85779 9.76492 21.2136 13.7838 15.8682 9.78826 numMergedOcc 0
15 mol 273 unq 1 iso 0 dist 9.79283 8.08262 9.84628 13.9497 8.85779 13.6188 21.2136 13.7838 17.2378 9.78826 numMergedOcc 0
16 mol 278 unq 0 iso 0 dist 8.56029 10.046 9.80746 8.73566 7.48235 14.8957 10.3898 10.3447 17.8924 9.21145 numMergedOcc 0
