0 mol 20 unq 0 iso 0 dist 7.53599 13.1319 9.33568 8.10407 8.81141 13.2155 numMergedOcc 0
1 mol 68 unq 0 iso 0 dist 7.94809 10.7844 9.23087 8.75627 5.44028 12.1527 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 8.88238 12.5791 5.52283 7.65955 5.64989 5.7253 numMergedOcc 0
3 mol 85 unq 0 iso 0 dist 7.82214 6.14753 7.54915 11.5334 6.00564 13.3069 numMergedOcc 0
4 mol 108 unq 0 iso 0 dist 8.92611 5.70307 5.37466 15.906 9.54994 12.7432 numMergedOcc 0
5 mol 108 unq 1 iso 0 dist 5.64136 8.67837 5.37466 5.65462 9.54994 12.7432 numMergedOcc 0
6 mol 109 unq 0 iso 0 dist 9.39787 10.5189 9.08102 4.89837 7.04752 5.70461 numMergedOcc 0
7 mol 111 unq 0 iso 0 dist 9.76075 11.5209 7.22098 6.40295 6.98727 7.13575 numMergedOcc 0
8 mol 120 unq 0 iso 0 dist 5.27549 7.45509 5.94417 12.7231 9.32166 5.72753 numMergedOcc 0
9 mol 154 unq 0 iso 0 dist 5.7306 13.588 9.58365 8.65195 6.61386 11.3572 numMergedOcc 0
10 mol 237 unq 0 iso 0 dist 9.81108 12.914 7.14928 10.205 8.32964 5.91026 numMergedOcc 0
11 mol 285 unq 0 iso 0 dist 6.02774 14.401 8.45077 10.0774 5.04032 6.93502 numMergedOcc 0
12 mol 285 unq 1 iso 0 dist 6.02774 14.401 8.45077 11.8393 8.48397 11.2993 numMergedOcc 0
