0 mol 41 unq 0 iso 0 dist 6.68599 13.8714 9.18836 11.9325 6.26099 6.73801 numMergedOcc 0
1 mol 41 unq 1 iso 0 dist 6.68599 7.50942 6.07294 11.9325 6.26099 6.42834 numMergedOcc 0
2 mol 64 unq 0 iso 0 dist 9.5663 5.40109 9.23947 11.6368 5.68492 9.32552 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 9.23755 15.0981 6.82707 12.341 9.24886 8.10446 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 6.30598 10.6525 8.83135 9.07918 3.97167 6.05495 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 8.98532 10.2731 6.15654 14.7696 6.3678 6.72712 numMergedOcc 0
6 mol 92 unq 1 iso 0 dist 8.98532 10.2731 6.15654 13.8802 7.31722 5.39745 numMergedOcc 0
7 mol 115 unq 0 iso 0 dist 7.11102 11.6661 7.81731 5.43229 5.80806 7.70313 numMergedOcc 0
8 mol 128 unq 0 iso 0 dist 7.94925 10.172 7.61237 16.3728 10.8984 6.98158 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 5.19029 5.16948 8.36723 7.17226 5.73251 6.71555 numMergedOcc 0
10 mol 148 unq 0 iso 0 dist 5.78662 7.65889 9.77704 6.91289 5.85057 8.28564 numMergedOcc 0
11 mol 188 unq 0 iso 0 dist 6.07498 4.75808 6.20426 10.7079 9.12244 9.33696 numMergedOcc 0
12 mol 204 unq 0 iso 0 dist 6.58174 11.4894 9.23676 9.01666 5.64245 7.10526 numMergedOcc 0
13 mol 227 unq 0 iso 0 dist 8.76741 13.2515 9.62583 11.4952 5.52229 9.52615 numMergedOcc 0
14 mol 266 unq 0 iso 0 dist 6.20998 7.30886 6.77259 9.15288 5.18289 9.71152 numMergedOcc 0
15 mol 280 unq 0 iso 0 dist 8.64546 10.8277 7.42529 11.1831 5.97333 5.80452 numMergedOcc 0
16 mol 280 unq 1 iso 0 dist 8.64546 10.8277 7.42529 12.5525 11.9982 7.82157 numMergedOcc 0
17 mol 280 unq 2 iso 0 dist 3.97964 5.51019 7.42529 6.78323 5.97333 5.80452 numMergedOcc 0
18 mol 280 unq 3 iso 0 dist 3.97964 5.51019 7.42529 10.4433 11.9982 7.82157 numMergedOcc 0
