0 mol 18 unq 0 iso 0 dist 6.60128 8.81762 8.45128 9.25676 7.06449 13.7346 numMergedOcc 0
1 mol 18 unq 1 iso 0 dist 6.60128 5.32149 9.88653 9.25676 7.06449 14.1976 numMergedOcc 0
2 mol 55 unq 0 iso 0 dist 8.77251 7.62383 5.70356 8.64474 8.33457 11.8166 numMergedOcc 0
3 mol 55 unq 1 iso 0 dist 7.74299 7.62383 4.83051 6.54959 9.81486 6.0933 numMergedOcc 0
4 mol 55 unq 2 iso 0 dist 7.74299 7.62383 4.83051 8.64474 8.87502 11.8166 numMergedOcc 0
5 mol 55 unq 3 iso 0 dist 4.74307 6.81152 5.53748 7.66644 9.35067 8.95052 numMergedOcc 0
6 mol 55 unq 4 iso 0 dist 6.36082 6.81152 4.53728 9.98357 8.33457 12.6266 numMergedOcc 0
7 mol 62 unq 0 iso 0 dist 9.00943 8.27156 4.05764 6.7153 9.36203 11.295 numMergedOcc 0
8 mol 90 unq 0 iso 0 dist 8.43532 9.25901 7.28798 11.8749 7.09826 14.3171 numMergedOcc 0
9 mol 90 unq 1 iso 0 dist 8.43532 7.96299 12.4809 11.8749 7.09826 17.76 numMergedOcc 0
10 mol 96 unq 0 iso 0 dist 7.93114 6.21351 9.89282 5.37184 6.26863 10.0597 numMergedOcc 0
11 mol 96 unq 1 iso 0 dist 9.56302 9.93617 9.89282 4.88554 6.26863 10.0597 numMergedOcc 0
12 mol 110 unq 0 iso 0 dist 8.14171 7.77678 6.30402 4.95967 9.67066 10.2389 numMergedOcc 0
13 mol 187 unq 0 iso 0 dist 9.469 9.38169 10.7804 4.62889 8.52941 13.0002 numMergedOcc 0
14 mol 225 unq 0 iso 0 dist 6.21062 8.14464 4.77967 4.20749 6.75968 6.51997 numMergedOcc 0
15 mol 225 unq 1 iso 0 dist 6.21062 9.93754 15.6895 4.20749 6.75968 12.2976 numMergedOcc 0
16 mol 233 unq 0 iso 0 dist 6.59321 6.48196 5.19558 5.36235 7.72115 4.94074 numMergedOcc 0
17 mol 233 unq 1 iso 0 dist 9.80759 6.48196 6.48373 5.36235 6.43615 4.94074 numMergedOcc 0
18 mol 236 unq 0 iso 0 dist 6.35418 9.07222 11.7774 12.5448 7.62034 17.6432 numMergedOcc 0
19 mol 236 unq 1 iso 0 dist 6.35418 9.09998 11.1911 12.5448 7.62034 18.4344 numMergedOcc 0
20 mol 285 unq 0 iso 0 dist 6.55498 9.82717 5.23192 12.6991 9.24084 10.6145 numMergedOcc 0
21 mol 285 unq 1 iso 0 dist 7.38219 9.82717 9.00041 12.6991 7.03138 10.6145 numMergedOcc 0
