0 mol 1 unq 0 iso 0 dist 8.15672 4.79345 9.21329 3.84685 8.54277 8.29622 numMergedOcc 0
1 mol 1 unq 0 iso 1 dist 8.15672 3.84685 8.54277 4.79345 9.21329 8.29622 numMergedOcc 0
2 mol 10 unq 0 iso 0 dist 9.6309 11.8229 9.9373 6.16158 8.4881 10.4192 numMergedOcc 0
3 mol 10 unq 0 iso 1 dist 9.6309 6.16158 8.4881 11.8229 9.9373 10.4192 numMergedOcc 0
4 mol 10 unq 1 iso 0 dist 8.76873 13.3283 9.9373 3.9468 8.4881 10.4192 numMergedOcc 0
5 mol 10 unq 1 iso 1 dist 8.76873 3.9468 8.4881 13.3283 9.9373 10.4192 numMergedOcc 0
6 mol 10 unq 2 iso 0 dist 9.58981 11.5823 9.9373 4.18003 8.4881 10.4192 numMergedOcc 0
7 mol 10 unq 2 iso 1 dist 9.58981 4.18003 8.4881 11.5823 9.9373 10.4192 numMergedOcc 0
8 mol 10 unq 3 iso 0 dist 9.23414 4.55975 9.97671 11.8229 7.83087 10.4382 numMergedOcc 0
9 mol 10 unq 3 iso 1 dist 9.23414 11.8229 7.83087 4.55975 9.97671 10.4382 numMergedOcc 0
10 mol 10 unq 4 iso 0 dist 9.23414 4.55975 9.97671 6.16158 9.37129 9.06785 numMergedOcc 0
11 mol 10 unq 4 iso 1 dist 9.23414 6.16158 9.37129 4.55975 9.97671 9.06785 numMergedOcc 0
12 mol 10 unq 4 iso 0 dist 9.23414 11.8229 7.83087 6.16158 9.37129 10.4192 numMergedOcc 0
13 mol 10 unq 4 iso 1 dist 9.23414 6.16158 9.37129 11.8229 7.83087 10.4192 numMergedOcc 0
14 mol 10 unq 5 iso 0 dist 8.44792 9.23608 5.8369 11.8998 8.06428 8.34698 numMergedOcc 0
15 mol 10 unq 5 iso 1 dist 8.44792 11.8998 8.06428 9.23608 5.8369 8.34698 numMergedOcc 0
16 mol 34 unq 0 iso 0 dist 7.36836 5.89139 5.68794 10.4748 8.9964 4.75078 numMergedOcc 0
17 mol 34 unq 0 iso 1 dist 7.36836 10.4748 8.9964 5.89139 5.68794 4.75078 numMergedOcc 0
18 mol 88 unq 0 iso 0 dist 9.40699 12.0479 8.73208 9.40927 5.60174 4.39437 numMergedOcc 0
19 mol 88 unq 0 iso 1 dist 9.40699 9.40927 5.60174 12.0479 8.73208 4.39437 numMergedOcc 0
20 mol 101 unq 0 iso 0 dist 6.67863 6.01775 7.33426 12.2942 8.17175 10.7319 numMergedOcc 0
21 mol 101 unq 0 iso 1 dist 6.67863 12.2942 8.17175 6.01775 7.33426 10.7319 numMergedOcc 0
22 mol 103 unq 0 iso 0 dist 5.53454 4.50663 9.0807 10.1927 9.70231 14.4929 numMergedOcc 0
23 mol 103 unq 0 iso 1 dist 5.53454 10.1927 9.70231 4.50663 9.0807 14.4929 numMergedOcc 0
24 mol 171 unq 0 iso 0 dist 7.06555 4.29743 9.73554 4.78402 8.65769 4.42585 numMergedOcc 0
25 mol 171 unq 0 iso 1 dist 7.06555 4.78402 8.65769 4.29743 9.73554 4.42585 numMergedOcc 0
26 mol 277 unq 0 iso 0 dist 8.72101 13.3688 9.07744 16.9673 8.42892 12.752 numMergedOcc 0
27 mol 277 unq 0 iso 1 dist 8.72101 16.9673 8.42892 13.3688 9.07744 12.752 numMergedOcc 0
28 mol 277 unq 1 iso 0 dist 8.72101 13.3688 9.07744 8.45252 8.90967 15.2073 numMergedOcc 0
29 mol 277 unq 1 iso 1 dist 8.72101 8.45252 8.90967 13.3688 9.07744 15.2073 numMergedOcc 0
30 mol 277 unq 1 iso 0 dist 8.72101 16.9673 8.42892 8.45252 8.90967 15.6008 numMergedOcc 0
31 mol 277 unq 1 iso 1 dist 8.72101 8.45252 8.90967 16.9673 8.42892 15.6008 numMergedOcc 0
32 mol 277 unq 2 iso 0 dist 5.11998 12.5633 9.07744 5.10572 8.42892 12.752 numMergedOcc 0
33 mol 277 unq 2 iso 1 dist 5.11998 5.10572 8.42892 12.5633 9.07744 12.752 numMergedOcc 0
34 mol 277 unq 3 iso 0 dist 5.11998 12.5633 9.07744 12.1971 8.90967 15.2073 numMergedOcc 0
35 mol 277 unq 3 iso 1 dist 5.11998 12.1971 8.90967 12.5633 9.07744 15.2073 numMergedOcc 0
36 mol 277 unq 3 iso 0 dist 5.11998 5.10572 8.42892 12.1971 8.90967 15.6008 numMergedOcc 0
37 mol 277 unq 3 iso 1 dist 5.11998 12.1971 8.90967 5.10572 8.42892 15.6008 numMergedOcc 0
38 mol 281 unq 0 iso 0 dist 6.82918 14.9508 9.39268 4.19307 9.06888 15.6382 numMergedOcc 0
39 mol 281 unq 0 iso 1 dist 6.82918 4.19307 9.06888 14.9508 9.39268 15.6382 numMergedOcc 0
40 mol 287 unq 0 iso 0 dist 9.40443 5.24841 5.44942 5.1508 8.53689 5.42655 numMergedOcc 0
41 mol 287 unq 0 iso 1 dist 9.40443 5.1508 8.53689 5.24841 5.44942 5.42655 numMergedOcc 0
42 mol 287 unq 1 iso 0 dist 9.40443 5.24841 5.44942 13.9608 7.82157 8.72516 numMergedOcc 0
43 mol 287 unq 1 iso 1 dist 9.40443 13.9608 7.82157 5.24841 5.44942 8.72516 numMergedOcc 0
44 mol 287 unq 1 iso 0 dist 9.40443 5.1508 8.53689 13.9608 7.82157 12.4945 numMergedOcc 0
45 mol 287 unq 1 iso 1 dist 9.40443 13.9608 7.82157 5.1508 8.53689 12.4945 numMergedOcc 0
46 mol 288 unq 0 iso 0 dist 9.40443 5.24841 5.44942 5.1508 8.53689 5.42655 numMergedOcc 0
47 mol 288 unq 0 iso 1 dist 9.40443 5.1508 8.53689 5.24841 5.44942 5.42655 numMergedOcc 0
48 mol 288 unq 1 iso 0 dist 9.40443 5.24841 5.44942 13.9608 7.82157 8.72516 numMergedOcc 0
49 mol 288 unq 1 iso 1 dist 9.40443 13.9608 7.82157 5.24841 5.44942 8.72516 numMergedOcc 0
50 mol 288 unq 1 iso 0 dist 9.40443 5.1508 8.53689 13.9608 7.82157 12.4945 numMergedOcc 0
51 mol 288 unq 1 iso 1 dist 9.40443 13.9608 7.82157 5.1508 8.53689 12.4945 numMergedOcc 0
52 mol 289 unq 0 iso 0 dist 9.40443 5.24841 5.44942 5.1508 8.53689 5.42655 numMergedOcc 0
53 mol 289 unq 0 iso 1 dist 9.40443 5.1508 8.53689 5.24841 5.44942 5.42655 numMergedOcc 0
54 mol 289 unq 1 iso 0 dist 9.40443 5.24841 5.44942 13.9608 7.82157 8.72516 numMergedOcc 0
55 mol 289 unq 1 iso 1 dist 9.40443 13.9608 7.82157 5.24841 5.44942 8.72516 numMergedOcc 0
56 mol 289 unq 1 iso 0 dist 9.40443 5.1508 8.53689 13.9608 7.82157 12.4945 numMergedOcc 0
57 mol 289 unq 1 iso 1 dist 9.40443 13.9608 7.82157 5.1508 8.53689 12.4945 numMergedOcc 0
