0 mol 9 unq 0 iso 0 dist 6.51397 12.8646 8.14998 16.7851 13.1565 5.85081 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 5.95165 10.5071 8.68293 12.4319 7.86896 9.08736 numMergedOcc 0
2 mol 11 unq 1 iso 0 dist 5.95165 9.80646 6.84216 12.4319 7.86896 9.74528 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 8.38387 4.15592 9.02471 10.0846 4.80528 8.81562 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 8.06168 15.6688 8.62079 13.7185 6.97502 4.8983 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 8.67532 8.22845 8.62079 8.09675 6.97502 4.8983 numMergedOcc 0
6 mol 78 unq 0 iso 0 dist 9.23023 15.1992 8.34957 15.0137 9.1771 9.93747 numMergedOcc 0
7 mol 88 unq 0 iso 0 dist 6.35462 4.56066 7.74064 5.74637 6.63027 5.6516 numMergedOcc 0
8 mol 113 unq 0 iso 0 dist 8.89481 7.52951 9.30832 15.7068 10.9135 9.57769 numMergedOcc 0
9 mol 122 unq 0 iso 0 dist 6.78949 6.80573 4.42563 11.1785 6.28781 4.821 numMergedOcc 0
10 mol 122 unq 1 iso 0 dist 9.40018 12.9961 4.42563 15.6575 6.28781 4.821 numMergedOcc 0
11 mol 129 unq 0 iso 0 dist 9.28278 3.54691 7.97548 7.13958 4.80675 4.4077 numMergedOcc 0
12 mol 129 unq 1 iso 0 dist 9.28278 5.56761 9.64164 7.13958 4.80675 8.4874 numMergedOcc 0
13 mol 129 unq 2 iso 0 dist 8.78082 3.54691 7.32151 7.13958 7.01358 4.4077 numMergedOcc 0
14 mol 152 unq 0 iso 0 dist 8.07256 12.8334 9.00072 21.0551 14.7437 9.07315 numMergedOcc 0
15 mol 157 unq 0 iso 0 dist 6.1835 6.11737 8.10592 13.0495 11.5877 7.75542 numMergedOcc 0
16 mol 167 unq 0 iso 0 dist 5.59806 5.09728 5.36671 11.6329 8.88239 8.06817 numMergedOcc 0
17 mol 175 unq 0 iso 0 dist 8.58906 3.47137 9.32259 7.7013 5.52686 8.06007 numMergedOcc 0
18 mol 206 unq 0 iso 0 dist 9.78438 10.3421 9.4629 10.7989 7.20088 5.73198 numMergedOcc 0
19 mol 214 unq 0 iso 0 dist 4.84709 6.62122 9.06459 11.277 14.5108 9.46274 numMergedOcc 0
20 mol 253 unq 0 iso 0 dist 8.91612 9.82989 8.94786 12.3062 6.27022 9.80396 numMergedOcc 0
21 mol 253 unq 1 iso 0 dist 8.91612 10.2284 9.1927 12.3062 6.27022 6.3093 numMergedOcc 0
22 mol 253 unq 2 iso 0 dist 8.91612 13.0515 9.27311 15.9246 8.65261 6.93942 numMergedOcc 0
23 mol 253 unq 3 iso 0 dist 8.91612 13.0515 9.27311 20.803 14.0529 9.31626 numMergedOcc 0
24 mol 274 unq 0 iso 0 dist 8.49076 7.72539 8.12739 6.28023 7.23876 8.67957 numMergedOcc 0
25 mol 277 unq 0 iso 0 dist 8.96343 7.9169 7.42932 11.7826 10.4297 4.1545 numMergedOcc 0
26 mol 277 unq 1 iso 0 dist 9.29635 7.31817 4.9764 6.70414 5.77904 4.1545 numMergedOcc 0
27 mol 277 unq 2 iso 0 dist 9.29635 3.91224 6.36559 6.70414 5.77904 4.25172 numMergedOcc 0
28 mol 287 unq 0 iso 0 dist 9.53313 6.09704 9.76232 10.8483 5.10722 8.73403 numMergedOcc 0
29 mol 287 unq 1 iso 0 dist 7.26542 5.42266 9.76232 7.47179 5.10722 8.73403 numMergedOcc 0
30 mol 288 unq 0 iso 0 dist 9.53313 6.09704 9.76232 10.8483 5.10722 8.73403 numMergedOcc 0
31 mol 288 unq 1 iso 0 dist 7.26542 5.42266 9.76232 7.47179 5.10722 8.73403 numMergedOcc 0
32 mol 289 unq 0 iso 0 dist 9.53313 6.09704 9.76232 10.8483 5.10722 8.73403 numMergedOcc 0
33 mol 289 unq 1 iso 0 dist 7.26542 5.42266 9.76232 7.47179 5.10722 8.73403 numMergedOcc 0
