0 mol 7 unq 0 iso 0 dist 8.41585 6.36911 6.06176 6.81066 10.6 5.28535 13.5229 7.78327 13.2302 17.844 numMergedOcc 0
1 mol 15 unq 0 iso 0 dist 6.82505 9.78051 5.55659 7.88714 4.13564 6.93503 3.78082 8.28153 11.7266 10.5674 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 4.51865 6.20943 4.69858 6.10339 4.13497 7.27506 4.44441 7.7312 6.38574 8.96634 numMergedOcc 0
3 mol 19 unq 1 iso 0 dist 6.864 8.78293 11.4401 6.50337 10.3465 4.73101 10.0411 7.7312 17.3652 14.404 numMergedOcc 0
4 mol 19 unq 2 iso 0 dist 6.864 8.23643 12.3093 6.50337 10.3465 12.9293 10.0411 7.7312 15.6781 14.404 numMergedOcc 0
5 mol 19 unq 3 iso 0 dist 6.864 7.82528 4.69858 6.50337 10.3465 13.3749 10.0411 7.7312 6.38574 14.404 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 5.93252 5.64598 9.77992 6.13011 4.22425 7.17738 3.85805 9.10566 7.78587 9.98262 numMergedOcc 0
7 mol 88 unq 0 iso 0 dist 9.36773 9.2603 6.95868 9.54952 11.9839 5.62882 10.8406 9.07128 15.0007 18.5551 numMergedOcc 0
8 mol 88 unq 1 iso 0 dist 9.36773 9.2603 6.95868 9.54952 11.9839 5.62882 4.47193 6.65615 9.08952 11.4934 numMergedOcc 0
9 mol 88 unq 2 iso 0 dist 8.31336 9.2603 6.97239 9.54952 10.6664 5.62882 4.47193 5.07548 9.08952 11.4934 numMergedOcc 0
10 mol 167 unq 0 iso 0 dist 9.87651 8.62646 6.58937 5.72735 6.38496 4.34476 12.8624 5.36671 11.4453 9.87581 numMergedOcc 0
11 mol 205 unq 0 iso 0 dist 7.26832 9.19704 6.23291 7.23959 12.3578 10.0576 13.3822 7.13783 12.4189 19.3257 numMergedOcc 0
12 mol 235 unq 0 iso 0 dist 5.4638 8.21247 4.65302 8.95981 4.60986 6.84517 4.75609 8.08965 9.11149 10.1399 numMergedOcc 0
13 mol 265 unq 0 iso 0 dist 8.4218 6.34034 6.43013 8.95701 5.78373 6.25678 7.71667 5.7944 8.03604 10.7671 numMergedOcc 0
14 mol 277 unq 0 iso 0 dist 9.7748 9.41725 6.58374 6.64082 10.9417 6.25097 7.75371 5.69112 9.62597 11.1081 numMergedOcc 0
15 mol 277 unq 1 iso 0 dist 9.7748 9.41725 6.58374 6.64082 10.9417 6.25097 11.3546 7.2091 11.5874 13.8832 numMergedOcc 0
