0 mol 7 unq 0 iso 0 dist 8.8576 10.4545 8.41585 8.401 5.99972 12.0193 6.68629 7.78327 13.5229 3.54153 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.13365 10.5449 6.86014 7.1011 7.33768 4.32034 6.09311 7.49157 8.66248 7.02381 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 8.13365 10.5449 6.86014 7.1011 7.33768 4.32034 9.56533 7.73794 6.73521 7.18485 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 8.13365 10.5449 6.86014 10.8208 9.01567 8.67951 6.09311 7.49157 8.66248 13.4969 numMergedOcc 0
4 mol 24 unq 3 iso 0 dist 8.13365 10.5449 6.86014 10.8208 9.01567 8.67951 9.56533 7.73794 6.73521 13.9252 numMergedOcc 0
5 mol 24 unq 4 iso 0 dist 8.13365 10.5449 6.86014 13.3998 7.29868 8.52463 6.09311 7.49157 8.66248 14.1137 numMergedOcc 0
6 mol 24 unq 5 iso 0 dist 8.13365 10.5449 6.86014 13.3998 7.29868 8.52463 9.56533 7.73794 6.73521 13.4584 numMergedOcc 0
7 mol 43 unq 0 iso 0 dist 8.47617 15.1595 8.80331 12.8271 8.95682 6.18002 14.2755 9.02471 12.6657 10.4863 numMergedOcc 0
8 mol 43 unq 1 iso 0 dist 8.47617 8.14351 6.20293 12.8271 8.95682 8.38399 14.2755 9.02471 14.0654 10.4863 numMergedOcc 0
9 mol 98 unq 0 iso 0 dist 4.31067 9.04817 5.08437 9.0917 6.65501 4.4057 11.3701 7.92856 8.29813 11.6496 numMergedOcc 0
10 mol 98 unq 1 iso 0 dist 4.31067 4.70157 6.48948 9.0917 6.65501 7.42446 11.3701 7.92856 13.2057 11.6496 numMergedOcc 0
11 mol 98 unq 2 iso 0 dist 4.31067 6.21302 6.10456 9.0917 6.65501 9.67482 11.3701 7.92856 12.7473 11.6496 numMergedOcc 0
12 mol 113 unq 0 iso 0 dist 8.29529 7.77295 5.86073 5.89952 8.8822 10.1816 3.7042 7.02367 5.37655 5.40648 numMergedOcc 0
13 mol 113 unq 1 iso 0 dist 8.29529 7.77295 5.86073 5.89952 8.8822 10.1816 12.8999 9.30832 5.46207 15.5674 numMergedOcc 0
14 mol 113 unq 2 iso 0 dist 8.29529 7.77295 5.86073 5.58964 9.66219 8.42718 3.7042 7.02367 5.37655 3.52111 numMergedOcc 0
15 mol 113 unq 3 iso 0 dist 8.29529 7.77295 5.86073 5.58964 9.66219 8.42718 12.8999 9.30832 5.46207 13.7232 numMergedOcc 0
16 mol 122 unq 0 iso 0 dist 8.054 9.57532 8.37808 5.97096 8.88537 5.0355 10.2953 4.42563 7.90729 8.90201 numMergedOcc 0
17 mol 122 unq 1 iso 0 dist 8.054 9.57532 8.37808 4.4646 9.23819 7.39059 10.2953 4.42563 7.90729 11.3935 numMergedOcc 0
18 mol 130 unq 0 iso 0 dist 7.94863 7.58865 9.28393 8.93581 7.96646 6.73735 5.17954 5.92733 6.00473 3.88766 numMergedOcc 0
19 mol 205 unq 0 iso 0 dist 6.04106 12.9245 7.26832 4.45301 5.44002 10.3603 3.95968 7.13783 13.3822 4.76454 numMergedOcc 0
20 mol 206 unq 0 iso 0 dist 7.94694 5.1071 7.7366 8.91883 6.16414 6.45859 5.69659 4.51255 7.83734 9.36584 numMergedOcc 0
21 mol 206 unq 1 iso 0 dist 7.94694 5.1071 7.7366 8.83227 7.33701 4.40897 5.69659 4.51255 7.83734 8.97305 numMergedOcc 0
22 mol 206 unq 2 iso 0 dist 7.94694 5.1071 7.7366 10.6714 8.0871 7.62219 5.69659 4.51255 7.83734 8.90838 numMergedOcc 0
23 mol 206 unq 3 iso 0 dist 7.51923 5.39127 8.02137 8.91883 7.75885 12.7604 5.69659 6.23183 8.20841 9.36584 numMergedOcc 0
24 mol 206 unq 4 iso 0 dist 7.51923 5.1071 9.774 8.91883 7.75885 6.45859 5.69659 6.23183 7.83734 9.36584 numMergedOcc 0
25 mol 235 unq 0 iso 0 dist 8.84872 4.28841 5.4638 9.6662 9.55668 7.60081 3.90737 8.08965 4.75609 6.82702 numMergedOcc 0
