0 mol 10 unq 0 iso 0 dist 7.57901 7.2786 9.88507 12.2016 10.9227 9.97671 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 4.9737 5.95398 5.56687 7.65918 5.54542 9.54171 numMergedOcc 0
2 mol 46 unq 0 iso 0 dist 8.12513 4.9813 8.23202 5.23918 6.64571 8.38624 numMergedOcc 0
3 mol 46 unq 1 iso 0 dist 6.9762 12.8946 8.23202 13.3299 6.64571 8.38624 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 8.69823 8.05728 7.1796 11.0048 3.60121 9.21776 numMergedOcc 0
5 mol 48 unq 1 iso 0 dist 8.69823 8.05728 7.1796 10.5978 3.65036 6.89752 numMergedOcc 0
6 mol 48 unq 2 iso 0 dist 8.69823 8.05728 7.1796 12.137 5.37655 6.85843 numMergedOcc 0
7 mol 48 unq 3 iso 0 dist 8.69823 8.76375 9.16212 11.0048 3.60121 9.40291 numMergedOcc 0
8 mol 48 unq 4 iso 0 dist 8.69823 8.76375 9.16212 12.137 5.37655 7.94814 numMergedOcc 0
9 mol 48 unq 5 iso 0 dist 8.69823 8.76375 9.16212 15.112 8.48119 9.55632 numMergedOcc 0
10 mol 130 unq 0 iso 0 dist 7.35647 14.7066 7.7461 6.90456 3.90693 9.58166 numMergedOcc 0
11 mol 130 unq 1 iso 0 dist 4.88366 10.7544 7.7461 8.14525 3.90693 9.58166 numMergedOcc 0
12 mol 131 unq 0 iso 0 dist 9.63085 9.5684 9.75061 11.3663 4.94367 7.34765 numMergedOcc 0
13 mol 169 unq 0 iso 0 dist 9.03552 12.3042 5.82321 10.0981 6.28646 6.27378 numMergedOcc 0
14 mol 169 unq 1 iso 0 dist 8.59976 11.3036 5.82321 14.6623 6.28646 6.27378 numMergedOcc 0
15 mol 173 unq 0 iso 0 dist 8.76228 12.523 8.14167 14.8037 8.66075 9.19939 numMergedOcc 0
16 mol 180 unq 0 iso 0 dist 8.67796 5.21444 9.72336 5.70326 5.46832 9.48707 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 5.31279 6.95271 8.91143 13.2135 14.9837 8.92335 numMergedOcc 0
18 mol 192 unq 0 iso 0 dist 9.36089 5.09521 8.29166 11.5386 13.9248 7.97601 numMergedOcc 0
19 mol 192 unq 1 iso 0 dist 8.25221 5.09521 8.14859 11.5386 6.73951 7.97601 numMergedOcc 0
20 mol 192 unq 2 iso 0 dist 6.64416 5.09521 5.62421 11.5386 6.53644 7.97601 numMergedOcc 0
21 mol 204 unq 0 iso 0 dist 6.67938 11.7954 7.59757 8.15587 6.52211 8.98633 numMergedOcc 0
22 mol 226 unq 0 iso 0 dist 7.71605 8.39762 6.45143 13.6637 10.1956 9.84378 numMergedOcc 0
23 mol 239 unq 0 iso 0 dist 9.94034 6.35573 5.95622 15.8497 9.24057 9.58325 numMergedOcc 0
24 mol 266 unq 0 iso 0 dist 8.38581 17.5836 9.34312 11.7545 4.60397 6.39822 numMergedOcc 0
25 mol 266 unq 1 iso 0 dist 8.38581 17.5836 9.34312 12.9106 5.26919 5.36518 numMergedOcc 0
26 mol 277 unq 0 iso 0 dist 6.71956 10.2688 9.35976 13.087 15.4432 9.07744 numMergedOcc 0
