0 mol 26 unq 0 iso 0 dist 9.63803 6.66387 5.84066 6.29311 6.73167 4.80984 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 9.90986 6.77783 9.06516 14.6525 6.38243 14.3325 numMergedOcc 0
2 mol 26 unq 2 iso 0 dist 9.90986 11.7823 9.96121 14.6525 6.38243 8.13684 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 9.78839 14.4774 7.08559 11.0338 9.58596 16.1649 numMergedOcc 0
4 mol 34 unq 1 iso 0 dist 9.78839 8.19638 8.63635 11.0338 9.58596 8.15141 numMergedOcc 0
5 mol 45 unq 0 iso 0 dist 8.69574 6.13812 5.81001 5.9084 7.72462 4.52443 numMergedOcc 0
6 mol 59 unq 0 iso 0 dist 9.01601 15.5086 8.35444 9.13337 7.17026 7.70178 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 9.43496 15.7577 9.39807 12.2875 6.9223 7.24263 numMergedOcc 0
8 mol 92 unq 1 iso 0 dist 9.43496 15.7577 9.39807 4.98638 7.0561 12.5937 numMergedOcc 0
9 mol 98 unq 0 iso 0 dist 5.33961 4.45424 4.44979 3.92844 6.83746 5.92812 numMergedOcc 0
10 mol 98 unq 1 iso 0 dist 5.33961 4.45424 4.44979 8.99706 9.14707 6.34014 numMergedOcc 0
11 mol 98 unq 2 iso 0 dist 8.3505 12.8333 6.61111 8.89866 8.75597 13.6622 numMergedOcc 0
12 mol 98 unq 3 iso 0 dist 8.3505 12.8333 6.61111 15.0551 9.18457 6.34014 numMergedOcc 0
13 mol 98 unq 4 iso 0 dist 9.29816 9.31771 4.44979 5.29931 6.83746 5.92812 numMergedOcc 0
14 mol 98 unq 5 iso 0 dist 9.29816 9.31771 4.44979 7.18776 9.14707 6.34014 numMergedOcc 0
15 mol 98 unq 6 iso 0 dist 5.08983 9.47873 4.44979 10.8121 6.83746 5.92812 numMergedOcc 0
16 mol 98 unq 7 iso 0 dist 5.08983 9.47873 4.44979 13.8773 9.14707 6.34014 numMergedOcc 0
17 mol 119 unq 0 iso 0 dist 5.90003 6.02826 6.55202 10.4469 9.6121 8.96522 numMergedOcc 0
18 mol 133 unq 0 iso 0 dist 9.76097 6.11049 8.50705 5.57319 9.05336 6.30647 numMergedOcc 0
19 mol 134 unq 0 iso 0 dist 8.78303 11.5532 7.43401 4.02705 5.11043 8.05714 numMergedOcc 0
20 mol 227 unq 0 iso 0 dist 8.79884 4.18393 7.79951 7.06191 5.28771 5.92529 numMergedOcc 0
21 mol 230 unq 0 iso 0 dist 8.98005 5.26751 8.10546 4.97784 7.07833 6.43742 numMergedOcc 0
22 mol 238 unq 0 iso 0 dist 7.13727 13.0115 9.84652 12.1653 6.53286 5.88491 numMergedOcc 0
23 mol 238 unq 1 iso 0 dist 8.56975 14.0686 9.84652 12.2456 6.53286 5.88491 numMergedOcc 0
24 mol 247 unq 0 iso 0 dist 9.01651 14.1218 8.53041 12.9282 9.92277 5.36525 numMergedOcc 0
25 mol 247 unq 1 iso 0 dist 8.83903 9.55655 8.53041 5.74872 9.92277 5.36525 numMergedOcc 0
26 mol 260 unq 0 iso 0 dist 7.27503 10.3966 8.5613 8.0809 9.65775 4.48119 numMergedOcc 0
27 mol 260 unq 1 iso 0 dist 7.27503 5.51525 5.7791 8.0809 9.65775 5.32038 numMergedOcc 0
28 mol 273 unq 0 iso 0 dist 8.89714 14.6301 9.06937 5.62645 5.4307 12.0694 numMergedOcc 0
29 mol 279 unq 0 iso 0 dist 7.59142 13.1267 8.92667 6.06247 5.81528 8.12656 numMergedOcc 0
30 mol 279 unq 1 iso 0 dist 7.59142 6.7711 6.0283 6.06247 5.81528 4.66909 numMergedOcc 0
