0 mol 24 unq 0 iso 0 dist 9.49404 14.0001 8.83657 8.74944 8.69288 6.50335 6.23313 8.85286 9.78196 5.69207 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 9.49404 14.0001 8.83657 4.80814 7.77964 10.0354 6.23313 8.85286 9.78196 5.49307 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 9.49404 10.5205 6.74914 8.74944 8.69288 3.79072 6.23313 8.85286 8.20543 5.69207 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 9.49404 10.5205 6.74914 4.80814 7.77964 6.08283 6.23313 8.85286 8.20543 5.49307 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 8.87762 7.4142 7.93454 12.2504 7.01952 12.5404 4.96658 9.41098 3.63648 14.0196 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 5.65006 4.63832 8.25047 10.0759 9.08825 11.5226 5.5308 5.45099 8.58059 5.16522 numMergedOcc 0
6 mol 76 unq 1 iso 0 dist 5.65006 4.63832 8.25047 10.0759 9.08825 11.5226 10.5881 8.44765 14.7497 9.60553 numMergedOcc 0
7 mol 76 unq 2 iso 0 dist 5.65006 4.63832 8.25047 10.0759 9.08825 11.5226 9.74852 9.06643 14.3572 12.9855 numMergedOcc 0
8 mol 79 unq 0 iso 0 dist 8.17687 5.60895 7.65917 4.9889 7.20211 6.55929 3.37256 9.54696 3.87187 5.54238 numMergedOcc 0
9 mol 79 unq 1 iso 0 dist 8.17687 5.60895 7.65917 4.9889 7.20211 6.55929 6.27386 4.62636 7.45894 3.12382 numMergedOcc 0
10 mol 107 unq 0 iso 0 dist 8.2411 12.2324 8.50257 4.11617 6.11492 10.6714 10.9097 7.91251 3.51814 10.4294 numMergedOcc 0
11 mol 107 unq 1 iso 0 dist 8.2411 12.2324 8.50257 4.11617 6.11492 10.6714 4.34186 9.09262 13.9569 3.40943 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 7.44523 14.0181 9.22792 8.84505 5.67168 5.44287 6.14958 6.94594 10.2655 4.97041 numMergedOcc 0
13 mol 186 unq 1 iso 0 dist 7.44523 14.0181 9.22792 8.84505 5.67168 5.44287 5.87342 5.81881 11.6331 6.50779 numMergedOcc 0
14 mol 233 unq 0 iso 0 dist 7.79426 5.09438 9.79864 4.12865 9.01338 5.47357 10.3577 8.4338 13.1316 8.6503 numMergedOcc 0
15 mol 243 unq 0 iso 0 dist 7.42359 6.96883 8.8602 5.69077 8.30024 3.98086 6.56644 9.53137 12.159 8.97648 numMergedOcc 0
16 mol 243 unq 1 iso 0 dist 7.42359 6.96883 8.8602 9.70906 8.20943 4.02386 6.56644 9.53137 12.159 14.0671 numMergedOcc 0
17 mol 243 unq 2 iso 0 dist 7.42359 5.23854 7.13476 5.69077 8.30024 4.03312 6.56644 9.53137 5.38511 8.97648 numMergedOcc 0
18 mol 243 unq 3 iso 0 dist 7.42359 5.23854 7.13476 9.70906 8.20943 9.0802 6.56644 9.53137 5.38511 14.0671 numMergedOcc 0
19 mol 243 unq 4 iso 0 dist 7.42359 13.6058 9.49016 5.69077 8.30024 12.1329 6.56644 9.53137 18.1416 8.97648 numMergedOcc 0
20 mol 243 unq 5 iso 0 dist 7.42359 13.6058 9.49016 9.70906 8.20943 6.41173 6.56644 9.53137 18.1416 14.0671 numMergedOcc 0
21 mol 279 unq 0 iso 0 dist 6.66483 6.52322 8.22717 5.58851 5.02349 4.30046 8.07304 7.90632 5.61835 3.36713 numMergedOcc 0
22 mol 279 unq 1 iso 0 dist 6.66483 6.52322 8.22717 8.15975 9.19322 5.29396 8.07304 7.90632 5.61835 10.4717 numMergedOcc 0
23 mol 279 unq 2 iso 0 dist 6.66483 11.2974 8.43409 5.58851 5.02349 8.90689 8.07304 7.90632 11.2075 3.36713 numMergedOcc 0
24 mol 279 unq 3 iso 0 dist 6.66483 11.2974 8.43409 8.15975 9.19322 5.61454 8.07304 7.90632 11.2075 10.4717 numMergedOcc 0
25 mol 279 unq 4 iso 0 dist 5.52111 4.84534 8.22717 4.84196 5.02349 4.30046 7.39007 7.90632 5.61835 3.36713 numMergedOcc 0
26 mol 279 unq 5 iso 0 dist 5.52111 4.84534 8.22717 4.98931 9.19322 5.29396 7.39007 7.90632 5.61835 10.4717 numMergedOcc 0
27 mol 279 unq 6 iso 0 dist 5.52111 4.0763 8.43409 4.84196 5.02349 8.90689 7.39007 7.90632 11.2075 3.36713 numMergedOcc 0
28 mol 279 unq 7 iso 0 dist 5.52111 4.0763 8.43409 4.98931 9.19322 5.61454 7.39007 7.90632 11.2075 10.4717 numMergedOcc 0
29 mol 292 unq 0 iso 0 dist 8.51266 7.39939 9.18386 6.03672 7.89938 6.59125 5.92057 9.56933 9.45033 3.44186 numMergedOcc 0
