0 mol 24 unq 0 iso 0 dist 6.36381 8.6586 3.67206 5.80023 7.27472 10.551 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 8.55202 8.79378 9.44812 4.53545 9.9787 10.4788 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 6.63973 6.46582 3.35924 9.42791 8.23026 9.92555 numMergedOcc 0
3 mol 78 unq 0 iso 0 dist 7.32064 8.48827 6.99884 7.17843 6.85523 7.91148 numMergedOcc 0
4 mol 78 unq 1 iso 0 dist 7.32064 8.48827 6.99884 13.1649 8.65848 12.2138 numMergedOcc 0
5 mol 78 unq 2 iso 0 dist 7.32064 7.14048 3.75261 7.17843 6.85523 6.59794 numMergedOcc 0
6 mol 78 unq 3 iso 0 dist 7.32064 7.14048 3.75261 13.1649 8.65848 10.167 numMergedOcc 0
7 mol 78 unq 4 iso 0 dist 4.62314 8.03895 6.99884 4.4651 6.85523 7.91148 numMergedOcc 0
8 mol 78 unq 5 iso 0 dist 4.62314 8.03895 6.99884 9.31889 8.65848 12.2138 numMergedOcc 0
9 mol 78 unq 6 iso 0 dist 4.62314 5.68873 3.75261 4.4651 6.85523 6.59794 numMergedOcc 0
10 mol 78 unq 7 iso 0 dist 4.62314 5.68873 3.75261 9.31889 8.65848 10.167 numMergedOcc 0
11 mol 78 unq 8 iso 0 dist 5.85007 8.48827 4.75637 7.17843 5.77326 7.91148 numMergedOcc 0
12 mol 78 unq 9 iso 0 dist 5.85007 7.14048 5.62063 7.17843 5.77326 6.59794 numMergedOcc 0
13 mol 78 unq 10 iso 0 dist 6.35234 8.03895 4.75637 4.4651 5.77326 7.91148 numMergedOcc 0
14 mol 78 unq 11 iso 0 dist 6.35234 5.68873 5.62063 4.4651 5.77326 6.59794 numMergedOcc 0
15 mol 92 unq 0 iso 0 dist 9.54368 8.30746 7.35325 5.1219 7.13008 4.17838 numMergedOcc 0
16 mol 92 unq 1 iso 0 dist 9.43496 8.14427 3.70642 9.56471 7.06939 9.48366 numMergedOcc 0
17 mol 98 unq 0 iso 0 dist 8.3505 9.68556 17.213 4.75138 5.10496 14.3025 numMergedOcc 0
18 mol 98 unq 1 iso 0 dist 8.3505 9.68556 17.213 10.4417 5.92242 17.4636 numMergedOcc 0
19 mol 98 unq 2 iso 0 dist 8.3505 9.68556 17.213 11.3628 5.2571 18.9347 numMergedOcc 0
20 mol 98 unq 3 iso 0 dist 8.3505 9.68556 17.213 13.9599 8.7497 21.7256 numMergedOcc 0
21 mol 98 unq 4 iso 0 dist 7.34638 9.68556 11.0062 10.4417 7.02507 17.4636 numMergedOcc 0
22 mol 109 unq 0 iso 0 dist 6.67635 6.3323 3.54756 10.0698 7.86666 9.82677 numMergedOcc 0
23 mol 109 unq 1 iso 0 dist 6.67635 6.3323 3.54756 11.8455 9.77497 10.2046 numMergedOcc 0
24 mol 113 unq 0 iso 0 dist 6.12348 7.08403 3.52445 14.0364 8.80934 7.02367 numMergedOcc 0
25 mol 127 unq 0 iso 0 dist 8.75894 8.94636 10.1848 4.70935 6.08673 11.0803 numMergedOcc 0
26 mol 129 unq 0 iso 0 dist 6.53559 7.04904 12.7725 6.43966 5.51197 13.0143 numMergedOcc 0
27 mol 129 unq 1 iso 0 dist 6.53559 5.06053 10.2785 6.43966 5.51197 10.4172 numMergedOcc 0
28 mol 129 unq 2 iso 0 dist 8.09774 7.84813 9.87781 5.56946 5.51197 7.97548 numMergedOcc 0
29 mol 129 unq 3 iso 0 dist 7.90844 7.04904 9.39617 6.43966 8.86944 13.0143 numMergedOcc 0
30 mol 129 unq 4 iso 0 dist 7.90844 5.06053 6.48525 6.43966 8.86944 10.4172 numMergedOcc 0
31 mol 168 unq 0 iso 0 dist 7.30338 8.97414 9.99868 12.1014 6.02086 15.6838 numMergedOcc 0
32 mol 168 unq 1 iso 0 dist 7.30338 8.00063 3.5168 12.1014 6.02086 8.92592 numMergedOcc 0
33 mol 184 unq 0 iso 0 dist 8.27396 9.10344 3.30691 4.41193 5.96423 8.22001 numMergedOcc 0
34 mol 186 unq 0 iso 0 dist 6.52441 6.99587 4.75583 11.7795 7.2793 11.8448 numMergedOcc 0
35 mol 186 unq 1 iso 0 dist 6.52441 4.37577 3.11607 11.7795 7.2793 10.0218 numMergedOcc 0
36 mol 188 unq 0 iso 0 dist 7.6482 8.85223 3.42559 6.04074 7.88013 7.86092 numMergedOcc 0
37 mol 188 unq 1 iso 0 dist 9.30803 8.85223 6.93096 6.04074 9.90062 7.86092 numMergedOcc 0
38 mol 205 unq 0 iso 0 dist 6.41148 8.93485 6.49396 4.2475 6.49765 9.31158 numMergedOcc 0
39 mol 205 unq 1 iso 0 dist 5.06713 5.66636 6.49396 6.8901 6.49765 9.31158 numMergedOcc 0
40 mol 270 unq 0 iso 0 dist 6.46935 7.97614 7.2389 5.00269 9.31275 8.65354 numMergedOcc 0
41 mol 270 unq 1 iso 0 dist 5.98384 7.97614 3.30547 5.00269 8.56508 8.65354 numMergedOcc 0
42 mol 274 unq 0 iso 0 dist 4.97796 9.82713 10.6981 4.56913 6.4611 13.2967 numMergedOcc 0
43 mol 285 unq 0 iso 0 dist 5.09181 5.28731 4.98469 4.16039 7.80862 5.03601 numMergedOcc 0
