0 mol 0 unq 0 iso 0 dist 7.55723 8.82652 5.56852 10.1875 11.5668 9.72725 12.7669 10.5071 6.0225 7.65806 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 6.22892 9.96415 6.88805 14.6751 10.5461 9.67164 14.5008 13.2247 13.156 7.10621 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 6.85331 8.14598 5.69214 9.20254 6.86014 7.95042 10.4452 10.0952 5.11636 8.86116 numMergedOcc 0
3 mol 38 unq 0 iso 0 dist 8.86547 4.74069 6.10572 7.46414 10.3882 7.26639 8.80956 6.52757 4.40004 7.50293 numMergedOcc 0
4 mol 38 unq 1 iso 0 dist 8.86547 4.74069 6.10572 7.46414 10.3882 7.26639 12.4417 12.2636 8.68364 9.91611 numMergedOcc 0
5 mol 56 unq 0 iso 0 dist 8.125 8.25594 13.2675 15.6547 22.1131 9.03564 14.6148 18.3594 6.75591 8.66265 numMergedOcc 0
6 mol 58 unq 0 iso 0 dist 9.58468 6.88243 6.24991 7.93761 11.3096 5.38524 11.2558 8.22697 5.61579 6.81627 numMergedOcc 0
7 mol 58 unq 1 iso 0 dist 9.58468 6.88243 6.24991 13.2851 14.1739 8.69057 11.2558 8.22697 5.61579 7.32874 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 9.89021 5.82056 14.3818 4.30874 11.1436 5.5087 11.6749 12.0013 11.2069 8.70481 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 9.89021 9.09115 16.9684 4.30874 11.1436 6.08682 11.6749 12.0013 10.6713 8.70481 numMergedOcc 0
10 mol 130 unq 0 iso 0 dist 7.21902 7.15213 9.11305 7.49673 13.1779 6.93139 11.7446 13.8413 4.97996 8.70949 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 7.15203 9.7105 6.9945 9.71227 8.22656 7.22643 11.0475 5.61668 4.19723 6.82262 numMergedOcc 0
12 mol 143 unq 0 iso 0 dist 8.90592 9.70788 11.903 10.1013 12.7524 7.36975 12.8179 14.5751 13.1926 5.99315 numMergedOcc 0
13 mol 155 unq 0 iso 0 dist 8.66709 5.55218 7.10286 13.8829 10.7829 8.97626 14.5075 10.7349 9.16779 7.46303 numMergedOcc 0
14 mol 155 unq 1 iso 0 dist 8.66709 5.55218 7.10286 13.8829 10.7829 8.97626 9.91732 10.7616 4.91785 6.43582 numMergedOcc 0
15 mol 181 unq 0 iso 0 dist 9.63295 8.39573 5.93724 12.5935 7.63312 9.01624 13.3844 8.85576 5.71898 7.81386 numMergedOcc 0
16 mol 277 unq 0 iso 0 dist 9.84188 9.91103 19.0436 5.77904 12.5685 8.9682 8.35794 5.59609 17.6038 9.7748 numMergedOcc 0
17 mol 277 unq 1 iso 0 dist 9.84188 7.0603 15.7645 5.77904 12.5685 6.92711 8.35794 5.59609 14.772 9.7748 numMergedOcc 0
