0 mol 7 unq 0 iso 0 dist 9.49401 14.8431 6.7985 14.3344 6.55304 9.60499 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.49401 18.245 9.68596 20.7193 14.7759 8.41585 numMergedOcc 0
2 mol 15 unq 0 iso 0 dist 5.94245 9.21064 7.48342 9.62668 4.39605 8.38064 numMergedOcc 0
3 mol 15 unq 1 iso 0 dist 5.94245 9.21064 7.48342 14.9916 12.1303 9.97507 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 9.67696 5.92191 7.33768 11.3578 4.32034 6.86014 numMergedOcc 0
5 mol 24 unq 1 iso 0 dist 8.12171 10.5449 9.41441 8.13365 6.66749 6.86014 numMergedOcc 0
6 mol 24 unq 2 iso 0 dist 8.12171 10.5449 9.41441 17.544 14.012 8.86116 numMergedOcc 0
7 mol 24 unq 3 iso 0 dist 8.12171 14.617 6.73939 20.1024 12.176 5.54419 numMergedOcc 0
8 mol 54 unq 0 iso 0 dist 6.54052 10.0565 6.14538 6.13476 4.29856 6.83299 numMergedOcc 0
9 mol 58 unq 0 iso 0 dist 8.80308 9.89708 9.92355 9.74058 5.78774 6.86465 numMergedOcc 0
10 mol 58 unq 1 iso 0 dist 8.80308 7.71984 5.93884 9.74058 5.78774 6.62496 numMergedOcc 0
11 mol 58 unq 2 iso 0 dist 8.80308 4.67517 7.68678 9.74058 5.78774 6.35756 numMergedOcc 0
12 mol 113 unq 0 iso 0 dist 9.17878 6.46081 8.8822 12.0029 10.1816 5.86073 numMergedOcc 0
13 mol 131 unq 0 iso 0 dist 8.9967 10.0484 9.90168 12.1672 7.7567 8.40312 numMergedOcc 0
14 mol 131 unq 1 iso 0 dist 8.9967 10.0484 9.90168 13.952 8.23791 7.12972 numMergedOcc 0
15 mol 131 unq 2 iso 0 dist 8.9967 10.0484 9.90168 16.6923 13.7237 6.85062 numMergedOcc 0
16 mol 167 unq 0 iso 0 dist 9.83216 9.58044 9.67741 17.0656 13.0123 9.87651 numMergedOcc 0
17 mol 181 unq 0 iso 0 dist 5.87853 6.73556 9.72611 7.15963 5.6044 5.98885 numMergedOcc 0
18 mol 181 unq 1 iso 0 dist 5.87853 6.73556 9.72611 11.5431 12.9468 9.09537 numMergedOcc 0
19 mol 181 unq 2 iso 0 dist 8.83185 5.49497 5.94469 12.074 7.77758 7.81386 numMergedOcc 0
20 mol 181 unq 3 iso 0 dist 8.83185 5.49497 5.94469 9.72791 12.5387 7.63312 numMergedOcc 0
21 mol 181 unq 4 iso 0 dist 9.0234 10.9813 5.94469 6.43406 7.77758 7.81386 numMergedOcc 0
22 mol 181 unq 5 iso 0 dist 9.0234 10.9813 5.94469 13.9818 12.5387 7.63312 numMergedOcc 0
23 mol 182 unq 0 iso 0 dist 9.38111 11.8631 7.09394 12.8688 9.37404 9.31746 numMergedOcc 0
24 mol 204 unq 0 iso 0 dist 9.639 12.1292 7.32294 6.73266 5.86489 8.51516 numMergedOcc 0
25 mol 223 unq 0 iso 0 dist 8.73987 11.1577 7.48463 17.3125 11.8654 8.77153 numMergedOcc 0
26 mol 223 unq 1 iso 0 dist 8.73987 11.1577 7.48463 14.4837 6.05524 8.6166 numMergedOcc 0
27 mol 229 unq 0 iso 0 dist 8.72409 4.98446 8.66332 10.3189 6.65022 8.22528 numMergedOcc 0
28 mol 234 unq 0 iso 0 dist 9.33455 12.2372 7.32499 16.592 10.7902 8.41436 numMergedOcc 0
29 mol 234 unq 1 iso 0 dist 9.33455 12.2372 7.32499 12.9314 4.4288 8.92474 numMergedOcc 0
30 mol 235 unq 0 iso 0 dist 9.22128 11.3444 9.55668 11.1531 7.60081 5.4638 numMergedOcc 0
31 mol 238 unq 0 iso 0 dist 6.62283 5.88384 9.24557 10.7019 14.7883 5.72887 numMergedOcc 0
32 mol 239 unq 0 iso 0 dist 9.61914 5.5592 9.01021 10.212 10.0842 7.00034 numMergedOcc 0
33 mol 249 unq 0 iso 0 dist 6.7282 8.71871 5.48118 14.3622 10.7772 7.57994 numMergedOcc 0
34 mol 249 unq 1 iso 0 dist 6.7282 8.71871 5.48118 12.4246 7.04666 6.18582 numMergedOcc 0
35 mol 278 unq 0 iso 0 dist 8.91606 15.2651 8.00673 13.5631 4.97614 8.44326 numMergedOcc 0
