0 mol 9 unq 0 iso 0 dist 9.3359 17.4263 8.59513 20.7734 14.634 9.99657 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 9.76233 13.4378 9.81983 18.3042 9.26728 9.78754 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 8.1717 9.49599 8.21895 16.887 15.8916 8.2746 numMergedOcc 0
3 mol 98 unq 0 iso 0 dist 5.91023 6.1745 7.55367 6.31509 4.48773 9.25249 numMergedOcc 0
4 mol 98 unq 1 iso 0 dist 5.91023 6.1745 7.55367 8.49806 3.78499 8.41411 numMergedOcc 0
5 mol 113 unq 0 iso 0 dist 9.00481 7.02101 7.40338 12.1482 3.74516 9.66068 numMergedOcc 0
6 mol 113 unq 1 iso 0 dist 9.00481 5.95402 6.23759 6.28645 7.1034 5.37302 numMergedOcc 0
7 mol 113 unq 2 iso 0 dist 9.00481 5.95402 6.23759 12.1482 3.74516 8.03783 numMergedOcc 0
8 mol 113 unq 3 iso 0 dist 9.00481 5.95402 6.23759 14.3885 9.72813 8.47541 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 6.66313 10.2818 6.21165 8.08733 3.80816 8.4733 numMergedOcc 0
10 mol 119 unq 1 iso 0 dist 6.3646 10.6827 6.21165 4.90449 3.80816 8.4733 numMergedOcc 0
11 mol 135 unq 0 iso 0 dist 6.08242 4.75453 7.02963 6.1777 3.47015 5.43728 numMergedOcc 0
12 mol 135 unq 1 iso 0 dist 5.60595 4.14325 7.02963 6.29701 3.47015 5.43728 numMergedOcc 0
13 mol 169 unq 0 iso 0 dist 9.3206 6.08318 6.35799 6.57161 7.16323 5.51388 numMergedOcc 0
14 mol 169 unq 1 iso 0 dist 9.3206 6.08318 6.35799 12.3862 3.69097 8.17917 numMergedOcc 0
15 mol 169 unq 2 iso 0 dist 9.3206 6.08318 6.35799 14.6982 10.1079 8.68909 numMergedOcc 0
16 mol 169 unq 3 iso 0 dist 6.18165 15.414 9.84538 9.10097 4.24401 7.79437 numMergedOcc 0
17 mol 249 unq 0 iso 0 dist 5.3865 5.56847 8.76518 11.3174 14.8497 6.58109 numMergedOcc 0
18 mol 260 unq 0 iso 0 dist 7.22473 4.48112 6.49413 4.76689 3.48905 5.68717 numMergedOcc 0
19 mol 260 unq 1 iso 0 dist 6.02628 4.48112 6.12343 4.76689 3.43711 5.68717 numMergedOcc 0
20 mol 260 unq 2 iso 0 dist 7.13397 5.72956 6.49413 8.79012 3.48905 5.68717 numMergedOcc 0
21 mol 260 unq 3 iso 0 dist 5.33278 5.72956 4.52405 8.79012 8.84611 5.68717 numMergedOcc 0
