0 mol 7 unq 0 iso 0 dist 6.22892 7.15287 8.41585 9.96415 6.88805 5.99459 14.6751 10.5461 12.2041 9.67164 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 6.22805 6.96396 7.10621 11.1727 7.12508 6.1206 15.2825 10.5461 13.2247 9.87885 numMergedOcc 0
2 mol 16 unq 0 iso 0 dist 7.46752 5.66097 7.63133 12.8674 9.81307 8.43054 12.558 12.5273 6.92781 6.57331 numMergedOcc 0
3 mol 60 unq 0 iso 0 dist 8.8058 12.5818 6.43294 12.3852 8.62476 7.57295 10.0675 8.7531 5.67502 8.4312 numMergedOcc 0
4 mol 60 unq 1 iso 0 dist 8.8058 12.5818 6.43294 12.3852 8.62476 7.57295 14.3334 11.5843 6.54743 7.48086 numMergedOcc 0
5 mol 60 unq 2 iso 0 dist 8.8058 10.0675 8.7531 12.3852 8.62476 8.4312 12.5818 6.43294 5.67502 7.57295 numMergedOcc 0
6 mol 60 unq 3 iso 0 dist 8.8058 10.0675 8.7531 12.3852 8.62476 8.4312 14.3334 11.5843 5.00018 7.48086 numMergedOcc 0
7 mol 88 unq 0 iso 0 dist 7.76275 13.1838 9.36773 15.8947 12.1193 7.80898 17.2723 16.8013 12.1547 7.51139 numMergedOcc 0
8 mol 95 unq 0 iso 0 dist 9.40559 11.8978 8.03644 15.1845 15.6249 8.27883 10.1724 11.3446 6.59884 7.7152 numMergedOcc 0
9 mol 115 unq 0 iso 0 dist 7.44784 7.64822 7.30858 14.1895 15.3161 9.42082 9.97256 13.8473 7.69052 6.39384 numMergedOcc 0
10 mol 115 unq 1 iso 0 dist 9.56867 9.97256 6.11741 14.1895 6.07067 6.39384 7.64822 7.88312 7.69052 9.42082 numMergedOcc 0
11 mol 115 unq 2 iso 0 dist 9.56867 7.64822 7.88312 14.1895 6.07067 9.42082 9.97256 6.11741 7.69052 6.39384 numMergedOcc 0
12 mol 119 unq 0 iso 0 dist 6.85677 4.99061 6.18601 10.7143 4.39676 8.95212 14.536 10.1813 10.9871 6.99446 numMergedOcc 0
13 mol 119 unq 1 iso 0 dist 6.85677 4.99061 6.18601 10.7143 4.39676 8.95212 14.2612 9.72413 9.93257 7.64052 numMergedOcc 0
14 mol 134 unq 0 iso 0 dist 5.67862 9.52819 6.37586 16.1624 10.8635 9.33094 12.4156 9.71307 6.81259 8.69531 numMergedOcc 0
15 mol 134 unq 1 iso 0 dist 5.67862 12.4156 9.71307 19.6139 15.0225 9.1998 19.6763 15.6507 11.6064 6.42772 numMergedOcc 0
16 mol 134 unq 2 iso 0 dist 5.67862 12.4156 9.71307 19.6139 15.0225 9.1998 19.0507 15.9508 7.09823 8.70621 numMergedOcc 0
17 mol 134 unq 3 iso 0 dist 5.67862 12.4156 9.71307 16.1624 10.8635 8.69531 9.52819 6.37586 6.81259 9.33094 numMergedOcc 0
18 mol 134 unq 4 iso 0 dist 7.97208 9.52819 6.49416 16.1624 12.3479 9.33094 12.4156 12.5075 6.81259 8.69531 numMergedOcc 0
19 mol 167 unq 0 iso 0 dist 7.83781 6.43506 9.87651 13.3506 12.0033 9.2289 8.89995 12.4733 4.70068 7.68266 numMergedOcc 0
20 mol 167 unq 1 iso 0 dist 7.83781 6.43506 9.87651 13.3506 12.0033 9.2289 15.3021 17.5366 10.3445 7.6616 numMergedOcc 0
21 mol 167 unq 2 iso 0 dist 7.83781 6.43506 9.87651 12.2826 11.6011 7.02548 8.89995 12.4733 4.70068 6.84752 numMergedOcc 0
22 mol 167 unq 3 iso 0 dist 7.83781 6.43506 9.87651 12.2826 11.6011 7.02548 15.3021 17.5366 10.3445 7.86563 numMergedOcc 0
23 mol 181 unq 0 iso 0 dist 9.63295 12.5935 7.63312 8.39573 5.93724 9.01624 4.681 9.11469 11.5866 5.05973 numMergedOcc 0
24 mol 224 unq 0 iso 0 dist 7.04127 4.55824 6.61986 5.36326 5.13732 8.08349 6.91193 13.4025 10.3613 9.78218 numMergedOcc 0
25 mol 238 unq 0 iso 0 dist 7.98022 6.3873 5.72887 14.5078 7.06793 9.72188 20.5516 14.6111 15.7907 9.12776 numMergedOcc 0
26 mol 259 unq 0 iso 0 dist 6.96379 10.908 8.13497 15.148 8.8603 9.07743 12.7595 7.88519 4.69778 7.66153 numMergedOcc 0
27 mol 259 unq 1 iso 0 dist 6.96379 12.7595 7.88519 15.148 8.8603 7.66153 10.908 8.13497 4.69778 9.07743 numMergedOcc 0
28 mol 277 unq 0 iso 0 dist 8.35794 5.77904 9.7748 9.91103 17.6038 8.9682 16.3552 21.4606 11.8268 9.57499 numMergedOcc 0
29 mol 277 unq 1 iso 0 dist 8.35794 5.77904 9.7748 9.91103 17.6038 8.9682 10.4297 16.3537 7.08227 5.46926 numMergedOcc 0
30 mol 277 unq 2 iso 0 dist 8.35794 5.77904 9.7748 7.0603 14.772 6.92711 10.4297 16.3537 7.08227 5.13913 numMergedOcc 0
31 mol 280 unq 0 iso 0 dist 8.27417 12.0417 6.53701 11.3818 4.90315 6.02353 7.26698 6.0664 5.51836 6.86234 numMergedOcc 0
32 mol 280 unq 1 iso 0 dist 8.27417 7.26698 6.0664 11.3818 4.90315 6.86234 12.0417 6.53701 5.51836 6.02353 numMergedOcc 0
