0 mol 16 unq 0 iso 0 dist 7.979 4.78943 8.17898 9.05346 12.0005 7.03948 5.48395 10.6491 6.92781 5.47769 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 7.979 4.78943 8.17898 9.05346 12.0005 7.03948 10.1011 15.8595 10.7015 6.58035 numMergedOcc 0
2 mol 85 unq 0 iso 0 dist 7.61312 7.83419 9.22376 14.6315 13.0379 7.22293 9.21014 9.8682 6.9948 9.47876 numMergedOcc 0
3 mol 87 unq 0 iso 0 dist 6.97882 11.2491 9.1329 16.4798 11.1364 7.51358 12.8734 9.03114 7.40574 8.32298 numMergedOcc 0
4 mol 87 unq 1 iso 0 dist 6.97882 12.8734 9.03114 16.4798 11.1364 8.32298 11.2491 9.1329 7.40574 7.51358 numMergedOcc 0
5 mol 87 unq 2 iso 0 dist 9.4868 11.2491 5.26938 16.4798 7.62644 7.51358 12.8734 8.91602 7.40574 8.32298 numMergedOcc 0
6 mol 87 unq 3 iso 0 dist 9.4868 12.8734 8.91602 16.4798 7.62644 8.32298 11.2491 5.26938 7.40574 7.51358 numMergedOcc 0
7 mol 87 unq 4 iso 0 dist 7.7858 11.2195 9.1329 12.7901 11.1364 7.51358 5.66355 9.03114 7.40574 8.32298 numMergedOcc 0
8 mol 87 unq 5 iso 0 dist 7.7858 5.66355 9.03114 12.7901 11.1364 8.32298 11.2195 9.1329 7.40574 7.51358 numMergedOcc 0
9 mol 92 unq 0 iso 0 dist 5.53726 4.33359 6.30103 10.8442 9.81259 7.06013 9.24395 10.2803 5.02055 5.81965 numMergedOcc 0
10 mol 92 unq 1 iso 0 dist 5.53726 4.33359 6.30103 10.8442 9.81259 7.06013 16.1863 14.2941 12.4494 9.70512 numMergedOcc 0
11 mol 130 unq 0 iso 0 dist 9.92685 10.5415 9.05626 9.82201 5.53247 6.89257 6.34984 10.2152 6.83397 6.79146 numMergedOcc 0
12 mol 130 unq 1 iso 0 dist 9.92685 10.5415 9.05626 9.82201 5.53247 6.89257 13.2362 12.8824 7.50049 7.66168 numMergedOcc 0
13 mol 130 unq 2 iso 0 dist 9.92685 10.5415 9.05626 15.6318 8.63186 8.74308 13.2362 12.8824 7.50049 9.12581 numMergedOcc 0
14 mol 132 unq 0 iso 0 dist 9.00166 4.90475 6.2403 10.9124 6.58856 6.03703 6.34266 8.34869 4.35917 7.61505 numMergedOcc 0
15 mol 132 unq 1 iso 0 dist 9.00166 6.34266 8.34869 10.9124 6.58856 7.61505 4.90475 6.2403 4.35917 6.03703 numMergedOcc 0
16 mol 132 unq 2 iso 0 dist 7.16287 4.90475 6.495 10.9124 10.343 6.03703 6.34266 9.43748 4.35917 7.61505 numMergedOcc 0
17 mol 132 unq 3 iso 0 dist 7.16287 6.34266 9.43748 10.9124 10.343 7.61505 4.90475 6.495 4.35917 6.03703 numMergedOcc 0
18 mol 143 unq 0 iso 0 dist 9.46039 5.80488 9.18691 9.9492 9.53126 7.7056 9.79072 13.6622 5.72828 7.31468 numMergedOcc 0
19 mol 155 unq 0 iso 0 dist 5.16143 5.01007 8.66709 8.02593 7.00069 7.39644 9.80448 9.91732 10.7616 7.36102 numMergedOcc 0
20 mol 155 unq 1 iso 0 dist 5.16143 5.01007 8.66709 12.3723 14.2312 7.70572 11.1249 15.5422 7.01918 8.65888 numMergedOcc 0
21 mol 155 unq 2 iso 0 dist 8.08392 12.7814 8.66709 8.77391 7.00069 7.39644 4.94973 9.91732 10.7616 7.36102 numMergedOcc 0
22 mol 155 unq 3 iso 0 dist 8.08392 12.7814 8.66709 17.5742 14.2312 7.70572 18.0797 15.5422 7.01918 8.65888 numMergedOcc 0
23 mol 236 unq 0 iso 0 dist 8.20542 11.2013 9.97357 6.98151 11.4732 7.17676 4.15973 6.36941 7.28249 5.34718 numMergedOcc 0
24 mol 236 unq 1 iso 0 dist 8.20542 4.15973 6.36941 6.98151 11.4732 5.34718 11.2013 9.97357 7.28249 7.17676 numMergedOcc 0
25 mol 282 unq 0 iso 0 dist 8.42335 4.64783 8.58671 8.96997 4.91806 6.85028 10.0286 11.0247 5.39891 7.32347 numMergedOcc 0
26 mol 282 unq 1 iso 0 dist 8.42335 4.64783 8.58671 8.96997 4.91806 6.85028 7.65702 10.3918 7.76539 8.3411 numMergedOcc 0
