0 mol 16 unq 0 iso 0 dist 7.979 6.36377 5.72175 4.78943 8.17898 5.05803 12.5063 8.17747 6.88552 9.30471 numMergedOcc 0
1 mol 59 unq 0 iso 0 dist 5.41134 6.65344 6.34748 13.1729 13.5562 7.71095 19.3836 16.8598 13.0222 9.83775 numMergedOcc 0
2 mol 59 unq 1 iso 0 dist 9.23605 6.65344 13.0793 13.1729 19.6226 7.71095 19.3836 22.669 13.0222 9.83775 numMergedOcc 0
3 mol 61 unq 0 iso 0 dist 6.71467 9.22002 10.8063 6.16737 10.755 6.65721 8.6338 7.92278 11.2947 8.44473 numMergedOcc 0
4 mol 61 unq 1 iso 0 dist 6.71467 7.52103 6.66385 6.16737 10.755 6.72123 8.6338 7.92278 4.78811 8.44473 numMergedOcc 0
5 mol 129 unq 0 iso 0 dist 7.13958 9.28278 4.80675 14.5776 10.1938 8.54584 19.2664 12.7795 10.4463 9.1987 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 4.69402 5.86531 6.25005 6.26797 10.4155 7.11802 12.4361 15.1329 11.0256 9.1146 numMergedOcc 0
7 mol 205 unq 0 iso 0 dist 7.97183 5.96555 4.25942 10.7091 10.4618 7.26832 9.65143 4.39855 5.04299 7.51951 numMergedOcc 0
8 mol 210 unq 0 iso 0 dist 5.33103 8.62103 11.5481 3.84723 6.53736 6.18308 5.70065 9.12311 5.4508 6.13878 numMergedOcc 0
9 mol 210 unq 1 iso 0 dist 9.01301 8.62103 8.72811 3.84723 8.18851 6.18308 5.70065 7.75472 5.4508 6.13878 numMergedOcc 0
10 mol 227 unq 0 iso 0 dist 9.87685 9.07872 17.4802 9.9474 19.7156 7.09863 17.3137 26.5148 10.9533 8.27093 numMergedOcc 0
11 mol 229 unq 0 iso 0 dist 5.75755 8.6537 12.696 10.7439 15.825 7.03423 16.6013 21.5305 9.15968 8.83023 numMergedOcc 0
12 mol 236 unq 0 iso 0 dist 8.20542 5.66569 10.2557 4.15973 6.36941 6.27581 9.51001 13.8826 10.5269 7.87233 numMergedOcc 0
13 mol 236 unq 1 iso 0 dist 5.6568 6.11137 6.49831 9.01197 12.2331 6.27581 12.9622 15.4882 10.5269 7.87233 numMergedOcc 0
