0 mol 11 unq 0 iso 0 dist 9.42442 6.42494 8.68636 9.23656 9.81247 12.3723 numMergedOcc 0
1 mol 59 unq 0 iso 0 dist 4.67917 6.88924 3.8971 8.85727 8.17564 7.19213 numMergedOcc 0
2 mol 59 unq 1 iso 0 dist 5.81747 6.81975 3.8971 4.07863 8.17564 7.19213 numMergedOcc 0
3 mol 59 unq 2 iso 0 dist 6.88924 4.67917 3.8971 8.85727 7.19213 8.17564 numMergedOcc 0
4 mol 59 unq 3 iso 0 dist 6.81975 5.81747 3.8971 4.07863 7.19213 8.17564 numMergedOcc 0
5 mol 78 unq 0 iso 0 dist 8.92399 9.28654 7.39248 9.26242 9.4909 10.1762 numMergedOcc 0
6 mol 181 unq 0 iso 0 dist 5.75545 8.86645 4.09371 6.22085 8.45395 9.15368 numMergedOcc 0
7 mol 181 unq 1 iso 0 dist 5.75545 8.86645 4.09371 4.48609 5.41368 7.96182 numMergedOcc 0
8 mol 181 unq 2 iso 0 dist 8.86645 5.75545 4.09371 6.22085 9.15368 8.45395 numMergedOcc 0
9 mol 181 unq 3 iso 0 dist 8.86645 5.75545 4.09371 4.48609 7.96182 5.41368 numMergedOcc 0
10 mol 183 unq 0 iso 0 dist 8.15747 8.74903 3.75614 9.54124 7.42108 11.0372 numMergedOcc 0
11 mol 183 unq 1 iso 0 dist 5.44125 7.11505 3.75614 9.81014 7.42108 11.0372 numMergedOcc 0
12 mol 183 unq 2 iso 0 dist 5.44125 8.7143 9.96454 9.81014 7.42108 9.19941 numMergedOcc 0
13 mol 183 unq 3 iso 0 dist 8.7143 5.44125 9.96454 9.81014 9.19941 7.42108 numMergedOcc 0
14 mol 183 unq 4 iso 0 dist 8.7143 7.11505 12.8714 9.81014 9.19941 11.0372 numMergedOcc 0
15 mol 185 unq 0 iso 0 dist 9.56016 9.52252 9.83918 11.0188 8.60027 15.0402 numMergedOcc 0
16 mol 185 unq 1 iso 0 dist 7.92501 8.27418 6.40496 7.3365 8.60027 12.9521 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 9.51177 7.82564 5.00891 13.1765 9.46582 10.4661 numMergedOcc 0
18 mol 238 unq 1 iso 0 dist 9.51177 7.82564 5.00891 14.6367 9.77231 12.9182 numMergedOcc 0
19 mol 243 unq 0 iso 0 dist 5.86679 8.28347 6.68091 4.12468 8.53888 9.46855 numMergedOcc 0
20 mol 243 unq 1 iso 0 dist 8.28347 5.86679 6.68091 4.12468 9.46855 8.53888 numMergedOcc 0
21 mol 247 unq 0 iso 0 dist 9.65548 8.05213 7.30919 4.32191 9.6455 9.59481 numMergedOcc 0
22 mol 247 unq 1 iso 0 dist 9.65548 8.67304 15.059 4.32191 9.6455 12.8794 numMergedOcc 0
23 mol 259 unq 0 iso 0 dist 5.30455 6.8184 5.25523 6.58569 8.46351 10.9956 numMergedOcc 0
