0 mol 11 unq 0 iso 0 dist 6.58046 8.01262 13.3327 10.7048 6.83186 18.4817 15.1065 12.0683 22.5699 9.89425 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.23075 4.7841 6.0925 13.5399 8.25818 10.2171 10.9113 11.1587 8.72577 7.7447 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 7.15542 8.89047 6.87266 6.88863 8.22812 4.22002 13.0948 9.26377 4.88527 7.78689 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 7.15542 8.89003 4.62605 6.88863 8.22812 5.77855 13.0948 9.26377 4.76279 7.78689 numMergedOcc 0
4 mol 48 unq 2 iso 0 dist 8.89047 7.15542 6.87266 6.88863 4.22002 8.22812 13.0948 4.88527 9.26377 7.78689 numMergedOcc 0
5 mol 48 unq 3 iso 0 dist 8.89047 8.89003 3.23184 6.88863 4.22002 5.77855 13.0948 4.88527 4.76279 7.78689 numMergedOcc 0
6 mol 48 unq 4 iso 0 dist 8.89003 7.15542 4.62605 6.88863 5.77855 8.22812 13.0948 4.76279 9.26377 7.78689 numMergedOcc 0
7 mol 48 unq 5 iso 0 dist 8.89003 8.89047 3.23184 6.88863 5.77855 4.22002 13.0948 4.76279 4.88527 7.78689 numMergedOcc 0
8 mol 78 unq 0 iso 0 dist 8.97888 9.85512 3.46822 9.6123 8.61143 11.407 12.0052 4.315 4.76861 9.38837 numMergedOcc 0
9 mol 78 unq 1 iso 0 dist 8.97888 9.85512 3.46822 9.6123 8.61143 11.407 15.2056 9.00868 12.1208 9.80913 numMergedOcc 0
10 mol 79 unq 0 iso 0 dist 4.37025 5.25027 5.30569 8.95695 6.20144 9.56766 11.2699 7.19532 10.2908 4.74254 numMergedOcc 0
11 mol 113 unq 0 iso 0 dist 7.02367 9.30832 10.8127 13.0914 7.02358 13.6813 8.80934 3.52445 10.4701 4.30875 numMergedOcc 0
12 mol 115 unq 0 iso 0 dist 4.76974 8.0336 3.66281 6.61688 6.21029 8.16325 9.24977 7.30495 9.57858 9.45013 numMergedOcc 0
13 mol 115 unq 1 iso 0 dist 8.0336 4.76974 3.66281 6.61688 8.16325 6.21029 9.24977 9.57858 7.30495 9.45013 numMergedOcc 0
14 mol 120 unq 0 iso 0 dist 6.42623 8.95899 8.68088 3.35803 6.98791 11.3644 9.85307 4.5296 12.5572 9.98772 numMergedOcc 0
15 mol 169 unq 0 iso 0 dist 9.37946 9.13646 9.48187 5.38859 6.96715 11.3131 11.1627 13.5169 14.0427 9.06172 numMergedOcc 0
16 mol 169 unq 1 iso 0 dist 9.37946 9.13646 9.48187 5.38859 6.96715 11.3131 11.4792 14.673 16.4806 8.93091 numMergedOcc 0
17 mol 169 unq 2 iso 0 dist 9.37946 8.34216 12.9271 5.38859 6.96715 12.6178 11.1627 13.5169 15.3629 9.06172 numMergedOcc 0
18 mol 169 unq 3 iso 0 dist 9.37946 8.34216 12.9271 5.38859 6.96715 12.6178 11.4792 14.673 17.2494 8.93091 numMergedOcc 0
19 mol 213 unq 0 iso 0 dist 4.66576 9.09354 11.4531 7.49785 9.71831 14.9013 12.9743 14.4808 16.0044 9.02881 numMergedOcc 0
20 mol 277 unq 0 iso 0 dist 5.69112 7.2091 3.75238 11.8607 7.98956 11.2004 12.1398 10.5214 14.236 5.13533 numMergedOcc 0
