0 mol 16 unq 0 iso 0 dist 9.45103 10.2769 8.63347 5.61445 6.57331 5.38671 8.82587 4.65873 8.33883 5.05803 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 9.45103 10.2769 8.63347 12.5048 8.43054 5.45161 8.82587 4.65873 8.33883 6.31718 numMergedOcc 0
2 mol 16 unq 2 iso 0 dist 9.45103 10.2769 8.63347 12.5048 8.43054 5.45161 17.6238 9.81307 9.79958 7.63133 numMergedOcc 0
3 mol 72 unq 0 iso 0 dist 5.49421 5.70904 9.86502 6.12361 7.66093 7.06403 6.7212 7.07356 12.2812 9.78528 numMergedOcc 0
4 mol 130 unq 0 iso 0 dist 9.58844 5.74226 6.98077 7.21973 6.93139 5.50335 9.77934 4.97996 10.0634 8.70949 numMergedOcc 0
5 mol 178 unq 0 iso 0 dist 9.03126 11.2892 6.95432 9.74132 7.06025 12.2822 12.3456 6.42973 8.0974 6.69288 numMergedOcc 0
6 mol 186 unq 0 iso 0 dist 7.12029 4.83829 9.82338 5.77884 6.61112 10.568 12.2764 11.0961 16.7935 7.54065 numMergedOcc 0
7 mol 222 unq 0 iso 0 dist 8.51427 10.6493 5.07975 5.60111 5.56538 5.66819 5.47561 6.84862 11.0097 7.21333 numMergedOcc 0
8 mol 224 unq 0 iso 0 dist 5.88041 10.2723 8.83742 13.1803 8.08349 10.9485 10.6043 5.13732 12.5309 6.61986 numMergedOcc 0
9 mol 243 unq 0 iso 0 dist 5.54003 4.96479 7.89993 7.95216 8.67156 12.7467 12.7318 9.89868 17.0043 8.23192 numMergedOcc 0
10 mol 273 unq 0 iso 0 dist 8.28809 11.2108 9.45329 6.69098 9.59325 7.52275 13.6003 12.2939 12.4988 9.01049 numMergedOcc 0
11 mol 276 unq 0 iso 0 dist 8.51449 7.93109 7.11952 6.33662 8.6759 9.95911 13.9936 9.39944 15.3786 9.8993 numMergedOcc 0
12 mol 276 unq 1 iso 0 dist 8.51449 7.93109 7.11952 6.33662 8.6759 9.95911 8.79189 8.26321 13.3495 6.87396 numMergedOcc 0
13 mol 276 unq 2 iso 0 dist 7.70127 6.3939 7.11952 9.58401 8.6759 9.95911 12.5562 9.39944 15.3786 9.8993 numMergedOcc 0
14 mol 276 unq 3 iso 0 dist 7.70127 6.3939 7.11952 9.58401 8.6759 9.95911 13.4249 8.26321 13.3495 6.87396 numMergedOcc 0
