0 mol 46 unq 0 iso 0 dist 5.02642 6.70122 6.02472 10.0975 6.81182 5.53419 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 9.04514 13.4485 9.48288 15.8762 10.6872 6.28603 numMergedOcc 0
2 mol 48 unq 1 iso 0 dist 9.04514 13.4485 9.48288 14.7613 9.24728 8.80303 numMergedOcc 0
3 mol 48 unq 2 iso 0 dist 9.04514 13.4485 9.48288 14.4979 6.44604 7.11491 numMergedOcc 0
4 mol 48 unq 3 iso 0 dist 9.14072 13.7632 9.16212 15.9124 10.5404 5.73454 numMergedOcc 0
5 mol 48 unq 4 iso 0 dist 9.14072 13.7632 9.16212 14.7031 9.35478 8.2012 numMergedOcc 0
6 mol 48 unq 5 iso 0 dist 9.14072 13.7632 9.16212 14.9479 6.4561 7.1829 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 5.55798 6.04435 5.33546 7.06029 4.13187 6.86517 numMergedOcc 0
8 mol 83 unq 0 iso 0 dist 6.77845 10.4266 5.68212 9.94528 4.48523 8.99451 numMergedOcc 0
9 mol 83 unq 1 iso 0 dist 5.48555 7.34738 5.68212 8.94777 4.48523 8.99451 numMergedOcc 0
10 mol 83 unq 2 iso 0 dist 5.39805 6.63513 5.68212 9.28583 4.48523 8.99451 numMergedOcc 0
11 mol 116 unq 0 iso 0 dist 9.62357 5.57288 6.74026 8.50194 5.94177 8.58308 numMergedOcc 0
12 mol 129 unq 0 iso 0 dist 5.16531 7.03404 6.52844 7.04904 4.39633 8.98175 numMergedOcc 0
13 mol 146 unq 0 iso 0 dist 6.14952 6.27901 6.47434 11.2499 7.73553 6.73137 numMergedOcc 0
14 mol 168 unq 0 iso 0 dist 5.60956 6.62718 5.24076 6.48066 3.60864 6.12453 numMergedOcc 0
15 mol 168 unq 1 iso 0 dist 5.60956 6.62718 5.24076 11.6064 7.08284 9.87447 numMergedOcc 0
16 mol 169 unq 0 iso 0 dist 6.09291 8.92988 5.82321 7.50458 10.1931 7.85698 numMergedOcc 0
17 mol 169 unq 1 iso 0 dist 6.09291 8.92988 5.82321 15.1799 9.3331 8.75484 numMergedOcc 0
18 mol 169 unq 2 iso 0 dist 9.76796 9.36083 5.82321 13.1014 10.1931 7.85698 numMergedOcc 0
19 mol 169 unq 3 iso 0 dist 9.76796 9.36083 5.82321 13.331 9.3331 8.75484 numMergedOcc 0
20 mol 169 unq 4 iso 0 dist 9.90583 6.9276 5.82321 11.8729 10.1931 7.85698 numMergedOcc 0
21 mol 169 unq 5 iso 0 dist 9.90583 6.9276 5.82321 11.22 9.3331 8.75484 numMergedOcc 0
22 mol 186 unq 0 iso 0 dist 7.81904 5.98598 4.65126 10.1955 3.87593 5.25762 numMergedOcc 0
23 mol 258 unq 0 iso 0 dist 8.43002 10.318 7.87648 18.292 11.8118 9.36974 numMergedOcc 0
