0 mol 16 unq 0 iso 0 dist 8.59049 5.11248 6.72833 6.21616 6.86055 5.94982 5.70228 4.7319 6.51133 7.65889 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 8.59049 5.11248 6.72833 6.21616 6.86055 5.94982 5.61445 11.0958 5.30082 6.42835 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 8.20058 13.4836 8.60554 19.4811 14.8647 6.61696 17.0327 13.2433 5.11617 5.68215 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 8.20058 13.4836 8.60554 11.6434 5.11636 5.80953 16.6906 8.86116 8.52463 7.95042 numMergedOcc 0
4 mol 24 unq 2 iso 0 dist 8.20058 9.04355 9.44691 13.2071 14.4081 9.586 12.9556 15.5296 6.7828 7.27472 numMergedOcc 0
5 mol 25 unq 0 iso 0 dist 9.22151 6.63966 8.50222 14.5916 13.2447 9.16515 12.2441 12.7009 5.77929 6.55597 numMergedOcc 0
6 mol 25 unq 1 iso 0 dist 9.22151 6.63966 8.50222 15.9245 11.8139 9.82987 12.2441 12.7009 5.77929 7.07751 numMergedOcc 0
7 mol 25 unq 2 iso 0 dist 9.22151 6.63966 8.50222 9.95169 5.18617 6.53269 4.96681 7.57578 6.08585 9.48085 numMergedOcc 0
8 mol 25 unq 3 iso 0 dist 9.22151 6.63966 8.50222 9.95169 5.18617 6.53269 12.2441 12.7009 5.77929 9.49421 numMergedOcc 0
9 mol 25 unq 4 iso 0 dist 6.22122 6.63966 7.55264 14.5916 14.9982 9.16515 12.2441 12.8117 5.77929 6.55597 numMergedOcc 0
10 mol 25 unq 5 iso 0 dist 6.22122 6.63966 7.55264 15.9245 14.1251 9.82987 12.2441 12.8117 5.77929 7.07751 numMergedOcc 0
11 mol 25 unq 6 iso 0 dist 6.22122 6.63966 7.55264 9.95169 5.68041 6.53269 4.96681 7.17969 6.08585 9.48085 numMergedOcc 0
12 mol 25 unq 7 iso 0 dist 6.22122 6.63966 7.55264 9.95169 5.68041 6.53269 12.2441 12.8117 5.77929 9.49421 numMergedOcc 0
13 mol 72 unq 0 iso 0 dist 6.68311 15.1138 9.27838 12.0518 5.69391 7.58875 15.0607 9.96708 11.6378 9.55118 numMergedOcc 0
14 mol 98 unq 0 iso 0 dist 8.05602 11.0132 6.65501 15.2414 10.4782 8.46823 18.6493 17.4071 16.4267 9.64383 numMergedOcc 0
15 mol 98 unq 1 iso 0 dist 8.05602 11.0132 6.65501 15.2414 10.4782 8.46823 12.0339 6.10456 9.67482 7.54889 numMergedOcc 0
16 mol 98 unq 2 iso 0 dist 8.05602 11.0132 6.65501 15.2414 10.4782 8.46823 16.9512 10.1136 12.0974 7.78931 numMergedOcc 0
17 mol 98 unq 3 iso 0 dist 8.05602 11.0132 6.65501 9.55337 3.9764 4.62494 12.0507 5.08437 4.4057 5.10496 numMergedOcc 0
18 mol 98 unq 4 iso 0 dist 8.05602 11.0132 6.65501 9.55337 3.9764 4.62494 4.72129 6.48948 7.42446 5.92242 numMergedOcc 0
19 mol 98 unq 5 iso 0 dist 8.05602 11.0132 6.65501 9.55337 3.9764 4.62494 12.0339 6.10456 9.67482 5.2571 numMergedOcc 0
20 mol 98 unq 6 iso 0 dist 8.05602 11.0132 6.65501 9.55337 3.9764 4.62494 16.9512 10.1136 12.0974 8.7497 numMergedOcc 0
21 mol 100 unq 0 iso 0 dist 5.70279 10.838 8.30845 10.7785 6.23008 6.59691 5.85449 6.65086 5.80144 8.91882 numMergedOcc 0
22 mol 100 unq 1 iso 0 dist 5.70279 10.838 8.30845 10.7785 6.23008 6.59691 16.0226 13.2001 5.42531 9.21662 numMergedOcc 0
23 mol 109 unq 0 iso 0 dist 8.84523 10.8869 7.80523 13.0202 5.00433 7.56755 19.9585 13.1098 10.0688 9.89083 numMergedOcc 0
24 mol 109 unq 1 iso 0 dist 8.84523 10.8869 7.80523 13.0202 5.00433 7.56755 14.7654 8.69985 7.74599 8.52024 numMergedOcc 0
25 mol 129 unq 0 iso 0 dist 6.23966 5.85167 7.58957 8.46972 6.28232 6.34626 10.1294 10.1333 4.92472 5.51197 numMergedOcc 0
26 mol 155 unq 0 iso 0 dist 5.68636 5.52764 7.92304 8.14405 4.91785 9.16358 7.92939 6.43582 5.50031 8.97626 numMergedOcc 0
27 mol 222 unq 0 iso 0 dist 5.47561 10.3328 7.67576 8.51427 6.84862 8.43195 5.60111 7.21333 7.75656 5.56538 numMergedOcc 0
28 mol 222 unq 1 iso 0 dist 5.47561 10.3328 7.67576 11.6182 9.53117 8.23406 5.60111 7.21333 7.75656 7.48954 numMergedOcc 0
29 mol 229 unq 0 iso 0 dist 8.8557 10.4939 8.66332 10.3383 5.70473 9.37336 5.65373 8.22528 6.65022 7.27993 numMergedOcc 0
30 mol 229 unq 1 iso 0 dist 8.8557 10.4939 8.66332 10.3383 5.70473 9.37336 10.5148 11.3979 5.42069 9.51168 numMergedOcc 0
31 mol 229 unq 2 iso 0 dist 8.8557 10.4939 8.66332 10.3383 5.70473 9.37336 11.9921 11.7165 10.2411 6.95201 numMergedOcc 0
32 mol 232 unq 0 iso 0 dist 8.89211 7.46856 8.50102 15.7335 9.74344 9.9183 12.2002 10.5803 4.9377 6.71524 numMergedOcc 0
33 mol 274 unq 0 iso 0 dist 5.82876 4.48276 7.46394 5.64169 5.22914 7.77765 11.5127 12.3938 9.5468 9.30212 numMergedOcc 0
34 mol 274 unq 1 iso 0 dist 5.82876 4.48276 7.46394 13.5288 14.7507 9.65868 11.5127 12.3938 9.5468 6.4611 numMergedOcc 0
35 mol 274 unq 2 iso 0 dist 8.71129 4.48276 7.1729 5.64169 10.2884 7.77765 11.5127 13.5896 9.5468 9.30212 numMergedOcc 0
36 mol 274 unq 3 iso 0 dist 8.71129 4.48276 7.1729 13.5288 13.0867 9.65868 11.5127 13.5896 9.5468 6.4611 numMergedOcc 0
