0 mol 16 unq 0 iso 0 dist 8.59049 5.11248 6.72833 8.82587 10.4852 6.93532 6.21616 6.86055 5.94982 5.01101 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 8.20058 13.4836 8.60554 15.5985 14.6259 8.4051 19.4811 14.8647 6.61696 10.1698 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 8.20058 13.4836 8.60554 15.5985 14.6259 8.4051 11.6434 5.11636 5.80953 13.6174 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 8.20058 13.4836 8.60554 17.2959 10.0952 7.29868 19.4811 14.8647 6.61696 8.91183 numMergedOcc 0
4 mol 24 unq 3 iso 0 dist 8.20058 13.4836 8.60554 17.2959 10.0952 7.29868 11.6434 5.11636 5.80953 5.69214 numMergedOcc 0
5 mol 24 unq 4 iso 0 dist 8.20058 9.04355 9.44691 15.5985 14.6259 8.75662 13.2071 14.4081 9.586 5.50396 numMergedOcc 0
6 mol 25 unq 0 iso 0 dist 9.22151 6.63966 8.50222 14.305 15.5644 8.87757 14.5916 13.2447 9.16515 4.69295 numMergedOcc 0
7 mol 25 unq 1 iso 0 dist 9.22151 6.63966 8.50222 14.305 15.5644 8.87757 15.9245 11.8139 9.82987 8.79309 numMergedOcc 0
8 mol 25 unq 2 iso 0 dist 9.22151 6.63966 8.50222 14.305 15.5644 8.87757 13.2138 6.28979 9.40732 14.9206 numMergedOcc 0
9 mol 25 unq 3 iso 0 dist 9.22151 6.63966 8.50222 14.305 15.5644 8.87757 9.95169 5.18617 6.53269 13.6145 numMergedOcc 0
10 mol 25 unq 4 iso 0 dist 9.22151 6.63966 8.50222 6.22122 4.33106 7.55264 14.5916 13.2447 9.16515 14.9982 numMergedOcc 0
11 mol 25 unq 5 iso 0 dist 9.22151 6.63966 8.50222 6.22122 4.33106 7.55264 15.9245 11.8139 9.82987 14.1251 numMergedOcc 0
12 mol 25 unq 6 iso 0 dist 9.22151 6.63966 8.50222 6.22122 4.33106 7.55264 13.2138 6.28979 9.40732 8.41421 numMergedOcc 0
13 mol 25 unq 7 iso 0 dist 9.22151 6.63966 8.50222 6.22122 4.33106 7.55264 9.95169 5.18617 6.53269 5.68041 numMergedOcc 0
14 mol 25 unq 8 iso 0 dist 6.22122 6.63966 7.55264 14.305 16.1048 8.87757 14.5916 14.9982 9.16515 4.69295 numMergedOcc 0
15 mol 25 unq 9 iso 0 dist 6.22122 6.63966 7.55264 14.305 16.1048 8.87757 15.9245 14.1251 9.82987 8.79309 numMergedOcc 0
16 mol 25 unq 10 iso 0 dist 6.22122 6.63966 7.55264 14.305 16.1048 8.87757 13.2138 8.41421 9.40732 14.9206 numMergedOcc 0
17 mol 25 unq 11 iso 0 dist 6.22122 6.63966 7.55264 14.305 16.1048 8.87757 9.95169 5.68041 6.53269 13.6145 numMergedOcc 0
18 mol 25 unq 12 iso 0 dist 6.22122 6.63966 7.55264 9.22151 4.33106 8.50222 14.5916 14.9982 9.16515 13.2447 numMergedOcc 0
19 mol 25 unq 13 iso 0 dist 6.22122 6.63966 7.55264 9.22151 4.33106 8.50222 15.9245 14.1251 9.82987 11.8139 numMergedOcc 0
20 mol 25 unq 14 iso 0 dist 6.22122 6.63966 7.55264 9.22151 4.33106 8.50222 13.2138 8.41421 9.40732 6.28979 numMergedOcc 0
21 mol 25 unq 15 iso 0 dist 6.22122 6.63966 7.55264 9.22151 4.33106 8.50222 9.95169 5.68041 6.53269 5.18617 numMergedOcc 0
22 mol 26 unq 0 iso 0 dist 7.46207 5.63833 6.46104 12.0856 7.96502 7.36856 9.56639 5.56139 6.07276 7.73394 numMergedOcc 0
23 mol 100 unq 0 iso 0 dist 5.70279 10.838 8.30845 11.3277 5.88134 7.01812 10.7785 6.23008 6.59691 4.03277 numMergedOcc 0
24 mol 141 unq 0 iso 0 dist 9.47675 9.00056 9.97343 16.9141 11.4307 9.70413 13.7901 13.4066 6.65731 8.54432 numMergedOcc 0
25 mol 171 unq 0 iso 0 dist 7.13441 8.99392 8.24693 15.1055 11.6409 6.64834 16.3943 14.4375 9.34834 8.99935 numMergedOcc 0
26 mol 171 unq 1 iso 0 dist 7.13441 8.99392 8.24693 15.1055 11.6409 6.64834 13.8812 13.6262 5.74846 7.15048 numMergedOcc 0
27 mol 171 unq 2 iso 0 dist 7.13441 8.99392 8.24693 12.2067 7.31409 5.93786 16.3943 14.4375 9.34834 9.35703 numMergedOcc 0
28 mol 171 unq 3 iso 0 dist 7.13441 8.99392 8.24693 12.2067 7.31409 5.93786 13.8812 13.6262 5.74846 9.14311 numMergedOcc 0
29 mol 171 unq 4 iso 0 dist 7.13441 8.99392 8.24693 15.9953 14.1033 7.36698 16.3943 14.4375 9.34834 4.66982 numMergedOcc 0
30 mol 171 unq 5 iso 0 dist 7.13441 8.99392 8.24693 15.9953 14.1033 7.36698 13.8812 13.6262 5.74846 3.65288 numMergedOcc 0
31 mol 195 unq 0 iso 0 dist 8.3705 11.3703 9.26504 15.8199 10.7531 7.36683 12.5713 6.04871 6.22742 5.41635 numMergedOcc 0
32 mol 232 unq 0 iso 0 dist 8.89211 7.46856 8.50102 13.0468 6.56633 9.40808 15.7335 9.74344 9.9183 5.10213 numMergedOcc 0
33 mol 274 unq 0 iso 0 dist 5.82876 4.48276 7.46394 12.6563 10.501 9.45514 5.64169 5.22914 7.77765 12.393 numMergedOcc 0
34 mol 274 unq 1 iso 0 dist 5.82876 4.48276 7.46394 12.6563 10.501 9.45514 13.5288 14.7507 9.65868 8.87855 numMergedOcc 0
35 mol 274 unq 2 iso 0 dist 5.82876 4.48276 7.46394 12.336 14.3919 8.91672 5.64169 5.22914 7.77765 16.5034 numMergedOcc 0
36 mol 274 unq 3 iso 0 dist 5.82876 4.48276 7.46394 12.336 14.3919 8.91672 13.5288 14.7507 9.65868 12.5615 numMergedOcc 0
37 mol 274 unq 4 iso 0 dist 5.82876 4.48276 7.46394 8.71129 6.15918 7.1729 5.64169 5.22914 7.77765 10.2884 numMergedOcc 0
38 mol 274 unq 5 iso 0 dist 5.82876 4.48276 7.46394 8.71129 6.15918 7.1729 13.5288 14.7507 9.65868 13.0867 numMergedOcc 0
39 mol 274 unq 6 iso 0 dist 8.71129 4.48276 7.1729 5.82876 6.15918 7.46394 5.64169 10.2884 7.77765 5.22914 numMergedOcc 0
40 mol 274 unq 7 iso 0 dist 8.71129 4.48276 7.1729 5.82876 6.15918 7.46394 13.5288 13.0867 9.65868 14.7507 numMergedOcc 0
41 mol 274 unq 8 iso 0 dist 8.71129 4.48276 7.1729 12.6563 6.828 9.45514 5.64169 10.2884 7.77765 12.393 numMergedOcc 0
42 mol 274 unq 9 iso 0 dist 8.71129 4.48276 7.1729 12.6563 6.828 9.45514 13.5288 13.0867 9.65868 8.87855 numMergedOcc 0
43 mol 274 unq 10 iso 0 dist 8.71129 4.48276 7.1729 12.336 10.0083 8.91672 5.64169 10.2884 7.77765 16.5034 numMergedOcc 0
44 mol 274 unq 11 iso 0 dist 8.71129 4.48276 7.1729 12.336 10.0083 8.91672 13.5288 13.0867 9.65868 12.5615 numMergedOcc 0
