0 mol 24 unq 0 iso 0 dist 8.86116 6.72502 6.58998 5.11636 7.95042 8.24948 8.60554 8.52463 6.99746 5.80953 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 5.04899 6.6492 9.20601 6.47509 7.05196 12.8378 7.45383 7.33728 11.7817 5.20109 numMergedOcc 0
2 mol 92 unq 0 iso 0 dist 9.33898 6.61823 6.08245 4.3481 7.06939 6.9223 9.75237 9.44576 8.67827 6.87506 numMergedOcc 0
3 mol 92 unq 1 iso 0 dist 9.33898 6.49956 6.86728 4.3481 7.06939 7.0561 9.75237 9.44576 13.0818 6.87506 numMergedOcc 0
4 mol 92 unq 2 iso 0 dist 9.64443 6.61823 7.24315 5.31547 9.36001 6.98037 9.75237 13.9524 8.67827 6.59716 numMergedOcc 0
5 mol 92 unq 3 iso 0 dist 9.64443 6.49956 12.163 5.31547 9.36001 11.0654 9.75237 13.9524 13.0818 6.59716 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 5.08437 7.26086 7.32662 3.9764 5.10496 8.75597 11.3043 7.94178 8.02554 9.84703 numMergedOcc 0
7 mol 98 unq 1 iso 0 dist 5.08437 7.26086 7.32662 3.9764 5.10496 8.75597 6.65501 4.4057 11.2092 4.62494 numMergedOcc 0
8 mol 98 unq 2 iso 0 dist 6.48948 7.26086 13.4985 3.9764 5.92242 8.75597 11.3043 15.7178 8.02554 9.84703 numMergedOcc 0
9 mol 98 unq 3 iso 0 dist 6.48948 7.26086 13.4985 3.9764 5.92242 8.75597 6.65501 7.42446 11.2092 4.62494 numMergedOcc 0
10 mol 98 unq 4 iso 0 dist 6.10456 7.26086 6.934 10.4782 7.54889 12.2279 6.65501 9.67482 11.2092 8.46823 numMergedOcc 0
11 mol 98 unq 5 iso 0 dist 6.10456 7.26086 6.934 10.4782 7.54889 12.2279 11.3043 9.85543 8.02554 9.25444 numMergedOcc 0
12 mol 98 unq 6 iso 0 dist 6.10456 7.26086 6.934 3.9764 5.2571 8.75597 11.3043 9.85543 8.02554 9.84703 numMergedOcc 0
13 mol 98 unq 7 iso 0 dist 6.10456 7.26086 6.934 3.9764 5.2571 8.75597 6.65501 9.67482 11.2092 4.62494 numMergedOcc 0
14 mol 109 unq 0 iso 0 dist 8.69985 5.34214 9.14441 5.00433 8.52024 9.78192 7.80523 7.74599 10.8469 7.56755 numMergedOcc 0
15 mol 119 unq 0 iso 0 dist 8.73993 7.77116 3.78311 9.68677 7.64052 9.57341 17.8739 12.0175 14.8901 8.67537 numMergedOcc 0
16 mol 133 unq 0 iso 0 dist 6.29155 6.76699 5.74088 13.0405 8.77023 11.9059 6.16242 4.54648 9.34112 8.83732 numMergedOcc 0
17 mol 143 unq 0 iso 0 dist 5.99315 8.41611 12.7056 4.78563 5.37047 13.1913 7.78652 6.48978 15.0801 5.06564 numMergedOcc 0
18 mol 143 unq 1 iso 0 dist 5.99315 8.41611 12.7056 4.78563 5.37047 13.1913 8.91301 5.20762 15.0315 7.5373 numMergedOcc 0
19 mol 143 unq 2 iso 0 dist 5.99315 7.63338 12.8872 4.78563 5.37047 10.6706 7.78652 6.48978 11.5146 5.06564 numMergedOcc 0
20 mol 143 unq 3 iso 0 dist 5.99315 7.63338 12.8872 4.78563 5.37047 10.6706 8.91301 5.20762 13.434 7.5373 numMergedOcc 0
21 mol 143 unq 4 iso 0 dist 5.99315 9.03707 7.76364 4.78563 5.37047 10.8457 7.78652 6.48978 8.97873 5.06564 numMergedOcc 0
22 mol 143 unq 5 iso 0 dist 5.99315 9.03707 7.76364 4.78563 5.37047 10.8457 8.91301 5.20762 6.29542 7.5373 numMergedOcc 0
23 mol 143 unq 6 iso 0 dist 5.99315 7.25673 9.23795 4.78563 5.37047 8.612 7.78652 6.48978 6.60479 5.06564 numMergedOcc 0
24 mol 143 unq 7 iso 0 dist 5.99315 7.25673 9.23795 4.78563 5.37047 8.612 8.91301 5.20762 7.54337 7.5373 numMergedOcc 0
25 mol 170 unq 0 iso 0 dist 9.76807 8.15099 7.72147 4.78249 9.51256 5.13268 6.35982 4.34698 7.29587 6.47164 numMergedOcc 0
26 mol 170 unq 1 iso 0 dist 9.76807 8.15099 7.72147 4.78249 9.51256 5.13268 7.51126 5.75144 8.73585 9.65126 numMergedOcc 0
27 mol 181 unq 0 iso 0 dist 9.1374 6.51749 13.8722 12.9532 9.76212 16.2165 12.4878 4.43096 17.0176 7.35884 numMergedOcc 0
28 mol 224 unq 0 iso 0 dist 6.61986 8.37597 4.59567 5.13732 8.08349 8.54702 10.0553 10.7174 10.0385 5.05368 numMergedOcc 0
29 mol 227 unq 0 iso 0 dist 7.22101 8.03442 10.5813 5.0317 5.23634 9.43618 7.43071 6.35849 12.8075 9.18728 numMergedOcc 0
30 mol 227 unq 1 iso 0 dist 7.22101 8.03442 10.5813 5.0317 5.23634 9.43618 5.41321 10.9607 4.59123 8.91971 numMergedOcc 0
31 mol 227 unq 2 iso 0 dist 8.65997 8.03442 7.22396 5.0317 6.91318 9.43618 7.43071 10.204 12.8075 9.18728 numMergedOcc 0
32 mol 227 unq 3 iso 0 dist 8.65997 8.03442 7.22396 5.0317 6.91318 9.43618 5.41321 9.72615 4.59123 8.91971 numMergedOcc 0
33 mol 252 unq 0 iso 0 dist 7.19638 7.50201 7.63376 7.40852 7.15764 5.9974 11.0831 6.35641 12.0545 8.09509 numMergedOcc 0
