0 mol 8 unq 0 iso 0 dist 6.68091 7.08043 6.92865 9.62683 8.89145 8.02605 9.86938 6.88402 8.99126 14.849 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 7.979 4.78943 8.17898 12.4209 9.04834 10.2656 9.05346 12.0005 7.03948 16.3417 numMergedOcc 0
2 mol 87 unq 0 iso 0 dist 6.97882 11.2491 9.1329 5.00184 9.33217 10.5639 16.4798 11.1364 7.51358 16.6571 numMergedOcc 0
3 mol 87 unq 1 iso 0 dist 6.97882 11.2491 9.1329 5.00184 9.33217 10.5639 19.1819 16.0648 8.93296 19.3091 numMergedOcc 0
4 mol 87 unq 2 iso 0 dist 6.97882 11.2491 9.1329 12.8734 9.03114 7.40574 16.4798 11.1364 7.51358 8.32298 numMergedOcc 0
5 mol 87 unq 3 iso 0 dist 6.97882 11.2491 9.1329 12.8734 9.03114 7.40574 19.1819 16.0648 8.93296 14.2495 numMergedOcc 0
6 mol 87 unq 4 iso 0 dist 6.97882 12.8734 9.03114 11.2491 9.1329 7.40574 16.4798 11.1364 8.32298 7.51358 numMergedOcc 0
7 mol 87 unq 5 iso 0 dist 6.97882 12.8734 9.03114 5.00184 9.33217 11.1798 16.4798 11.1364 8.32298 16.6571 numMergedOcc 0
8 mol 87 unq 6 iso 0 dist 9.4868 11.2491 5.26938 12.8734 8.91602 7.40574 16.4798 7.62644 7.51358 8.32298 numMergedOcc 0
9 mol 87 unq 7 iso 0 dist 9.4868 11.2491 5.26938 12.8734 8.91602 7.40574 19.1819 10.8096 8.93296 14.2495 numMergedOcc 0
10 mol 87 unq 8 iso 0 dist 9.4868 12.8734 8.91602 11.2491 5.26938 7.40574 16.4798 7.62644 8.32298 7.51358 numMergedOcc 0
11 mol 87 unq 9 iso 0 dist 7.7858 11.2195 9.1329 9.58456 9.33217 10.5639 12.7901 11.1364 7.51358 16.6571 numMergedOcc 0
12 mol 87 unq 10 iso 0 dist 7.7858 11.2195 9.1329 9.58456 9.33217 10.5639 19.0685 16.0648 8.93296 19.3091 numMergedOcc 0
13 mol 87 unq 11 iso 0 dist 7.7858 11.2195 9.1329 5.66355 9.03114 7.40574 12.7901 11.1364 7.51358 8.32298 numMergedOcc 0
14 mol 87 unq 12 iso 0 dist 7.7858 11.2195 9.1329 5.66355 9.03114 7.40574 19.0685 16.0648 8.93296 14.2495 numMergedOcc 0
15 mol 87 unq 13 iso 0 dist 7.7858 5.66355 9.03114 11.2195 9.1329 7.40574 12.7901 11.1364 8.32298 7.51358 numMergedOcc 0
16 mol 87 unq 14 iso 0 dist 7.7858 5.66355 9.03114 9.58456 9.33217 11.1798 12.7901 11.1364 8.32298 16.6571 numMergedOcc 0
17 mol 127 unq 0 iso 0 dist 5.52891 4.70935 8.62711 4.02121 6.65963 7.30196 12.3265 13.376 9.81878 11.7714 numMergedOcc 0
18 mol 132 unq 0 iso 0 dist 9.00166 4.90475 6.2403 6.34266 8.34869 4.35917 10.9124 6.58856 6.03703 7.61505 numMergedOcc 0
19 mol 132 unq 1 iso 0 dist 9.00166 6.34266 8.34869 4.90475 6.2403 4.35917 10.9124 6.58856 7.61505 6.03703 numMergedOcc 0
20 mol 132 unq 2 iso 0 dist 7.16287 4.90475 6.495 6.34266 9.43748 4.35917 10.9124 10.343 6.03703 7.61505 numMergedOcc 0
21 mol 132 unq 3 iso 0 dist 7.16287 6.34266 9.43748 4.90475 6.495 4.35917 10.9124 10.343 7.61505 6.03703 numMergedOcc 0
22 mol 175 unq 0 iso 0 dist 7.7013 12.3666 6.73365 12.3067 9.45659 5.35493 14.6759 7.92448 9.0664 11.5506 numMergedOcc 0
23 mol 175 unq 1 iso 0 dist 7.7013 12.3666 6.73365 7.28603 9.44856 9.63234 14.6759 7.92448 9.0664 14.78 numMergedOcc 0
24 mol 204 unq 0 iso 0 dist 4.45738 10.6493 7.7292 4.30341 6.27396 12.5143 13.9578 11.695 5.90931 16.9866 numMergedOcc 0
25 mol 219 unq 0 iso 0 dist 7.26376 5.0241 8.09769 4.36122 7.24832 7.02195 7.1158 7.42613 4.87541 10.105 numMergedOcc 0
26 mol 236 unq 0 iso 0 dist 8.20542 11.2013 9.97357 4.15973 6.36941 7.28249 6.98151 11.4732 7.17676 5.34718 numMergedOcc 0
27 mol 236 unq 1 iso 0 dist 8.20542 11.2013 9.97357 4.15973 6.36941 7.28249 12.9923 14.1057 6.68463 10.5713 numMergedOcc 0
28 mol 236 unq 2 iso 0 dist 8.20542 4.15973 6.36941 11.2013 9.97357 7.28249 6.98151 11.4732 5.34718 7.17676 numMergedOcc 0
29 mol 258 unq 0 iso 0 dist 9.17911 9.07364 9.67877 17.1229 8.81059 17.2075 11.5077 13.6436 6.49982 21.9033 numMergedOcc 0
30 mol 258 unq 1 iso 0 dist 9.17911 9.07364 9.67877 15.539 9.12006 18.4031 11.5077 13.6436 6.49982 22.7061 numMergedOcc 0
31 mol 258 unq 2 iso 0 dist 9.52903 14.2753 9.67877 7.52881 8.81059 17.2075 18.6418 13.6436 6.49982 21.9033 numMergedOcc 0
32 mol 258 unq 3 iso 0 dist 9.52903 14.2753 9.67877 12.3042 9.12006 18.4031 18.6418 13.6436 6.49982 22.7061 numMergedOcc 0
33 mol 284 unq 0 iso 0 dist 8.77418 5.88217 7.32482 4.45344 7.35866 5.87439 13.1279 9.91995 8.41504 10.0956 numMergedOcc 0
