0 mol 15 unq 0 iso 0 dist 8.38064 7.876 5.88545 4.29582 7.07399 9.41935 9.84471 5.49251 10.5167 6.23015 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 6.86014 9.61998 7.72775 6.66749 9.41441 11.6758 10.2862 9.88364 4.48718 9.85784 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 6.86014 9.61998 7.72775 6.66749 9.41441 11.6758 11.825 9.78753 6.4802 9.87996 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 9.96396 9.33919 7.9151 5.11416 9.24757 10.462 12.2276 6.20232 12.8099 8.96616 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 9.96396 9.33919 7.9151 5.11416 9.24757 10.462 9.73086 5.70116 10.4668 6.14542 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 6.19304 9.79143 7.9151 6.56633 9.24757 10.462 8.68662 6.20232 12.8099 8.96616 numMergedOcc 0
6 mol 73 unq 3 iso 0 dist 6.19304 9.79143 7.9151 6.56633 9.24757 10.462 7.4369 5.70116 10.4668 6.14542 numMergedOcc 0
7 mol 73 unq 4 iso 0 dist 8.70481 6.43377 7.9151 15.3808 9.24757 10.462 13.8931 6.20232 12.8099 8.96616 numMergedOcc 0
8 mol 73 unq 5 iso 0 dist 8.70481 6.43377 7.9151 15.3808 9.24757 10.462 12.8207 5.70116 10.4668 6.14542 numMergedOcc 0
9 mol 85 unq 0 iso 0 dist 7.97049 9.30021 10.4545 9.29301 9.82915 13.05 13.3997 11.9064 14.1135 5.05893 numMergedOcc 0
10 mol 85 unq 1 iso 0 dist 7.97049 9.30021 10.4545 9.29301 9.82915 13.05 14.6517 14.7521 16.4175 5.71866 numMergedOcc 0
11 mol 85 unq 2 iso 0 dist 7.47541 5.62635 10.4545 13.5116 9.82915 13.05 15.8175 11.9064 14.1135 5.05893 numMergedOcc 0
12 mol 85 unq 3 iso 0 dist 7.47541 5.62635 10.4545 13.5116 9.82915 13.05 18.2645 14.7521 16.4175 5.71866 numMergedOcc 0
13 mol 85 unq 4 iso 0 dist 7.47541 7.07868 9.87083 13.5116 9.82915 18.4974 15.8175 11.9064 19.6373 5.05893 numMergedOcc 0
14 mol 85 unq 5 iso 0 dist 7.47541 7.07868 9.87083 13.5116 9.82915 18.4974 18.2645 14.7521 22.8274 5.71866 numMergedOcc 0
15 mol 100 unq 0 iso 0 dist 7.17106 8.20656 8.07089 8.4128 7.01812 6.84692 10.5432 4.03277 8.59989 6.59691 numMergedOcc 0
16 mol 100 unq 1 iso 0 dist 9.35224 7.5951 6.35939 10.0456 7.01812 11.5672 11.5088 4.03277 8.30652 6.59691 numMergedOcc 0
17 mol 100 unq 2 iso 0 dist 6.56369 7.5951 4.46114 10.0456 8.30845 11.5672 11.5088 6.23008 8.30652 6.59691 numMergedOcc 0
18 mol 113 unq 0 iso 0 dist 5.86073 8.57673 5.05071 10.1816 8.8822 13.8879 15.7535 13.9729 18.167 9.30645 numMergedOcc 0
19 mol 119 unq 0 iso 0 dist 6.18601 9.70093 10.6133 5.13589 6.73586 13.9942 8.95212 4.39676 10.9729 8.67537 numMergedOcc 0
20 mol 133 unq 0 iso 0 dist 6.29155 4.51266 5.47259 4.54648 6.16242 6.49688 8.77023 13.0405 13.2024 8.83732 numMergedOcc 0
21 mol 133 unq 1 iso 0 dist 6.80239 4.51266 4.70102 4.54648 5.87634 6.49688 8.77023 13.7612 13.2024 8.83732 numMergedOcc 0
22 mol 181 unq 0 iso 0 dist 7.81386 8.47008 7.45927 7.20191 9.39829 10.9996 9.01624 5.71898 8.25265 5.99437 numMergedOcc 0
23 mol 181 unq 1 iso 0 dist 7.81386 8.47008 7.45927 7.20191 9.39829 10.9996 9.55105 5.83796 5.42919 8.4848 numMergedOcc 0
24 mol 181 unq 2 iso 0 dist 7.63312 8.47008 5.83639 5.63555 5.9176 6.2176 6.64173 10.6474 7.11838 8.12266 numMergedOcc 0
25 mol 181 unq 3 iso 0 dist 7.63312 8.47008 5.83639 5.63555 5.9176 6.2176 9.55105 5.12833 5.42919 9.43306 numMergedOcc 0
26 mol 181 unq 4 iso 0 dist 7.63312 8.47008 5.83639 5.63555 5.9176 6.2176 11.7785 4.61184 6.20414 8.59681 numMergedOcc 0
27 mol 181 unq 5 iso 0 dist 7.63312 8.47008 5.83639 7.20191 6.41453 10.9996 9.01624 5.93724 8.25265 5.99437 numMergedOcc 0
28 mol 181 unq 6 iso 0 dist 7.63312 8.47008 5.83639 7.20191 6.41453 10.9996 9.55105 5.12833 5.42919 8.4848 numMergedOcc 0
29 mol 274 unq 0 iso 0 dist 7.56915 6.92434 5.87456 5.29529 8.52587 5.0002 12.8334 16.9539 12.616 8.60027 numMergedOcc 0
30 mol 274 unq 1 iso 0 dist 7.56915 6.93875 8.83823 5.29529 8.52587 11.9154 12.8334 16.9539 19.7314 8.60027 numMergedOcc 0
31 mol 274 unq 2 iso 0 dist 7.56915 6.0868 9.51441 5.29529 8.52587 10.6062 12.8334 16.9539 17.511 8.60027 numMergedOcc 0
32 mol 274 unq 3 iso 0 dist 7.56915 6.32856 11.5556 5.29529 8.52587 9.1028 12.8334 16.9539 14.0768 8.60027 numMergedOcc 0
