0 mol 7 unq 0 iso 0 dist 8.23909 13.823 9.60499 10.4925 6.55304 6.7985 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.23909 13.823 9.60499 15.5222 12.2869 6.44736 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 9.85726 11.5784 9.60499 10.4728 8.43473 6.02702 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 6.72215 5.38502 9.60499 8.02892 6.55304 6.7985 numMergedOcc 0
4 mol 7 unq 4 iso 0 dist 6.72215 5.38502 9.60499 10.7001 12.2869 6.44736 numMergedOcc 0
5 mol 7 unq 5 iso 0 dist 7.21217 6.09254 7.10621 12.8055 13.8829 8.72114 numMergedOcc 0
6 mol 16 unq 0 iso 0 dist 6.29703 5.64581 4.86568 9.26933 5.39089 6.62144 numMergedOcc 0
7 mol 16 unq 1 iso 0 dist 5.84479 5.35079 6.31718 12.137 10.4366 6.93532 numMergedOcc 0
8 mol 24 unq 0 iso 0 dist 9.90845 9.59761 8.86116 16.7308 14.012 9.41441 numMergedOcc 0
9 mol 54 unq 0 iso 0 dist 6.59893 10.3564 6.83299 8.77224 4.29856 6.14538 numMergedOcc 0
10 mol 54 unq 1 iso 0 dist 5.59773 10.4238 6.83299 5.7405 4.29856 6.14538 numMergedOcc 0
11 mol 58 unq 0 iso 0 dist 7.84983 11.5882 6.62496 11.799 9.95364 8.80614 numMergedOcc 0
12 mol 58 unq 1 iso 0 dist 9.56737 11.5882 6.35756 11.799 5.49591 8.80614 numMergedOcc 0
13 mol 61 unq 0 iso 0 dist 9.62468 10.7369 6.65721 19.3555 13.5488 9.25641 numMergedOcc 0
14 mol 61 unq 1 iso 0 dist 5.92705 5.4671 6.65721 11.9267 13.5488 9.25641 numMergedOcc 0
15 mol 92 unq 0 iso 0 dist 9.514 11.8037 7.4729 7.44343 9.50382 6.95572 numMergedOcc 0
16 mol 92 unq 1 iso 0 dist 9.514 11.8037 7.4729 13.7462 12.7565 7.38677 numMergedOcc 0
17 mol 101 unq 0 iso 0 dist 8.77773 5.16122 6.57035 9.83799 5.53055 6.98314 numMergedOcc 0
18 mol 102 unq 0 iso 0 dist 9.10229 8.17186 7.36792 11.7662 7.42011 8.31932 numMergedOcc 0
19 mol 119 unq 0 iso 0 dist 6.49205 5.19198 6.18601 10.0649 5.13589 6.73586 numMergedOcc 0
20 mol 126 unq 0 iso 0 dist 9.54928 7.01529 6.06638 12.4696 6.0268 6.30546 numMergedOcc 0
21 mol 131 unq 0 iso 0 dist 8.97145 14.257 6.85062 20.6764 13.7237 9.90168 numMergedOcc 0
22 mol 131 unq 1 iso 0 dist 6.5874 7.60371 6.85062 15.7544 13.7237 9.90168 numMergedOcc 0
23 mol 133 unq 0 iso 0 dist 8.84018 8.00493 6.5107 13.4486 7.12976 6.66772 numMergedOcc 0
24 mol 133 unq 1 iso 0 dist 9.4473 15.4455 8.22656 19.1869 10.6025 7.71248 numMergedOcc 0
25 mol 134 unq 0 iso 0 dist 7.78849 11.454 9.89303 9.46933 4.60632 7.69991 numMergedOcc 0
26 mol 156 unq 0 iso 0 dist 7.30021 5.0966 7.44554 9.6281 5.4555 9.44367 numMergedOcc 0
27 mol 156 unq 1 iso 0 dist 7.30021 5.0966 7.44554 10.9903 11.9952 9.47433 numMergedOcc 0
28 mol 156 unq 2 iso 0 dist 7.30021 5.75141 8.94056 9.6281 5.4555 7.90267 numMergedOcc 0
29 mol 156 unq 3 iso 0 dist 6.71202 5.70205 7.66148 6.22667 6.03934 7.90267 numMergedOcc 0
30 mol 156 unq 4 iso 0 dist 9.16591 9.27577 9.83699 13.313 5.80008 9.4013 numMergedOcc 0
31 mol 175 unq 0 iso 0 dist 8.69888 7.39186 6.57069 15.8107 8.29015 9.77896 numMergedOcc 0
32 mol 175 unq 1 iso 0 dist 5.08206 5.77256 6.57069 11.0322 8.29015 9.77896 numMergedOcc 0
33 mol 180 unq 0 iso 0 dist 8.44989 9.76368 9.62337 12.9666 8.78204 5.85827 numMergedOcc 0
34 mol 181 unq 0 iso 0 dist 7.44191 9.60754 8.03334 13.0487 7.81713 6.2479 numMergedOcc 0
35 mol 181 unq 1 iso 0 dist 6.00053 11.1879 8.03334 12.5826 7.81713 6.2479 numMergedOcc 0
36 mol 182 unq 0 iso 0 dist 7.86625 5.40949 9.31746 9.68323 7.68794 6.73956 numMergedOcc 0
37 mol 182 unq 1 iso 0 dist 7.86625 5.40949 9.31746 10.8403 9.37404 7.09394 numMergedOcc 0
38 mol 220 unq 0 iso 0 dist 7.31105 14.6296 9.23153 12.6669 7.11498 6.59716 numMergedOcc 0
39 mol 224 unq 0 iso 0 dist 9.75313 6.46679 6.61986 13.8414 12.4692 9.51597 numMergedOcc 0
40 mol 224 unq 1 iso 0 dist 6.08709 7.85135 6.61986 15.5459 12.4692 9.51597 numMergedOcc 0
41 mol 231 unq 0 iso 0 dist 7.79865 5.3251 7.37839 11.2829 9.0443 7.79066 numMergedOcc 0
42 mol 231 unq 1 iso 0 dist 6.14348 5.3251 8.40182 11.2829 12.1512 7.79066 numMergedOcc 0
43 mol 234 unq 0 iso 0 dist 5.89084 4.74041 6.56247 10.2618 4.46561 9.81425 numMergedOcc 0
44 mol 234 unq 1 iso 0 dist 8.47009 4.74041 9.36357 10.2618 10.641 9.81425 numMergedOcc 0
45 mol 258 unq 0 iso 0 dist 8.58088 10.221 6.60405 12.1556 5.63675 7.21311 numMergedOcc 0
46 mol 259 unq 0 iso 0 dist 6.77279 5.71237 8.13497 9.69025 8.41846 7.98231 numMergedOcc 0
47 mol 259 unq 1 iso 0 dist 9.58006 5.71237 7.88519 9.69025 8.81835 7.98231 numMergedOcc 0
48 mol 259 unq 2 iso 0 dist 9.58006 11.8501 7.46176 9.69025 8.81835 7.08526 numMergedOcc 0
49 mol 261 unq 0 iso 0 dist 9.62828 10.5691 8.02547 12.9304 5.91643 8.43974 numMergedOcc 0
50 mol 264 unq 0 iso 0 dist 6.75305 10.0289 6.24356 9.14393 5.00209 7.16853 numMergedOcc 0
51 mol 274 unq 0 iso 0 dist 9.696 10.7962 7.56915 13.0106 5.29529 8.52587 numMergedOcc 0
