0 mol 28 unq 0 iso 0 dist 8.74311 5.9948 11.8164 8.24316 12.5941 8.34712 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 9.81779 7.55854 11.7708 7.49678 8.22614 9.90363 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 7.61029 8.25884 13.9975 5.04007 10.5254 5.00567 numMergedOcc 0
3 mol 68 unq 1 iso 0 dist 7.61029 8.25884 13.9975 6.60395 13.1001 5.33771 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 8.65864 9.0101 9.02965 7.52544 10.205 7.7047 numMergedOcc 0
5 mol 76 unq 1 iso 0 dist 8.65864 9.0101 9.02965 8.08674 7.90785 4.00834 numMergedOcc 0
6 mol 76 unq 2 iso 0 dist 8.65864 9.0101 9.02965 8.33694 15.3489 9.6911 numMergedOcc 0
7 mol 102 unq 0 iso 0 dist 6.54242 8.65586 4.82189 5.90675 7.4117 5.91317 numMergedOcc 0
8 mol 141 unq 0 iso 0 dist 6.75212 6.4822 9.27523 8.04823 11.7952 3.56357 numMergedOcc 0
9 mol 173 unq 0 iso 0 dist 9.90421 8.85548 8.0029 7.71773 7.82577 7.46995 numMergedOcc 0
10 mol 180 unq 0 iso 0 dist 9.1469 8.65601 14.0735 5.314 4.94642 9.74229 numMergedOcc 0
11 mol 180 unq 1 iso 0 dist 9.1469 5.78414 10.3303 5.314 4.94642 6.04558 numMergedOcc 0
12 mol 180 unq 2 iso 0 dist 5.9064 8.65601 13.2852 5.314 5.75763 9.74229 numMergedOcc 0
13 mol 180 unq 3 iso 0 dist 5.9064 5.78414 4.80648 5.314 5.75763 6.04558 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 4.42722 7.26569 4.72979 5.62758 6.90277 5.98722 numMergedOcc 0
15 mol 220 unq 1 iso 0 dist 4.42722 6.50591 6.24332 5.62758 6.90277 6.56312 numMergedOcc 0
16 mol 233 unq 0 iso 0 dist 7.72115 8.73545 5.5881 9.06221 14.739 12.4724 numMergedOcc 0
17 mol 233 unq 1 iso 0 dist 7.72115 8.14581 5.60683 9.06221 14.739 15.2442 numMergedOcc 0
18 mol 233 unq 2 iso 0 dist 6.43615 8.73545 11.4518 9.06221 14.6662 12.4724 numMergedOcc 0
19 mol 233 unq 3 iso 0 dist 6.43615 8.14581 3.75722 9.06221 14.6662 15.2442 numMergedOcc 0
