0 mol 32 unq 0 iso 0 dist 8.34024 8.39998 7.48825 8.91744 7.14527 4.62858 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 8.82122 15.3157 8.55901 12.1828 4.46241 8.90835 numMergedOcc 0
2 mol 34 unq 1 iso 0 dist 8.69203 9.34663 7.71914 13.9848 6.45654 8.2946 numMergedOcc 0
3 mol 34 unq 2 iso 0 dist 8.69203 9.34663 7.71914 17.2283 11.9626 9.25346 numMergedOcc 0
4 mol 37 unq 0 iso 0 dist 7.63645 4.68181 7.17699 7.65758 4.36537 6.84337 numMergedOcc 0
5 mol 45 unq 0 iso 0 dist 6.94727 11.5096 8.13782 12.3122 6.39184 5.55096 numMergedOcc 0
6 mol 48 unq 0 iso 0 dist 8.95084 13.4777 9.76285 19.598 13.0328 7.281 numMergedOcc 0
7 mol 48 unq 1 iso 0 dist 9.18584 13.7656 9.54797 20.0061 12.9941 7.34031 numMergedOcc 0
8 mol 48 unq 2 iso 0 dist 7.8518 6.73491 9.76285 12.7064 13.0328 7.281 numMergedOcc 0
9 mol 64 unq 0 iso 0 dist 9.14856 5.78769 8.4517 11.9735 6.90629 9.32552 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 8.33489 14.7186 6.4218 14.6531 7.99114 6.21403 numMergedOcc 0
11 mol 140 unq 0 iso 0 dist 7.79467 5.36419 5.63811 11.4012 4.35399 8.60108 numMergedOcc 0
12 mol 175 unq 0 iso 0 dist 6.84347 8.65486 4.79852 10.9997 4.30489 5.4997 numMergedOcc 0
13 mol 175 unq 1 iso 0 dist 6.84347 8.65486 4.79852 6.53696 4.57622 6.99693 numMergedOcc 0
14 mol 222 unq 0 iso 0 dist 8.56735 4.58537 6.94853 10.4826 6.08084 9.92417 numMergedOcc 0
15 mol 224 unq 0 iso 0 dist 8.77324 5.66992 4.55996 13.5373 6.09379 9.22384 numMergedOcc 0
16 mol 224 unq 1 iso 0 dist 8.77324 5.66992 4.55996 11.3309 6.99977 8.08737 numMergedOcc 0
17 mol 234 unq 0 iso 0 dist 8.79054 13.0843 9.6101 12.5509 4.51304 7.43663 numMergedOcc 0
18 mol 234 unq 1 iso 0 dist 8.79054 6.7061 5.32183 12.5509 4.51304 7.94068 numMergedOcc 0
19 mol 234 unq 2 iso 0 dist 8.79054 6.7061 5.32183 5.68253 6.56416 7.22019 numMergedOcc 0
20 mol 235 unq 0 iso 0 dist 7.29546 10.2924 7.27958 6.20377 4.29892 7.95766 numMergedOcc 0
21 mol 250 unq 0 iso 0 dist 9.91556 14.2012 7.88284 14.6626 9.48491 6.44252 numMergedOcc 0
22 mol 254 unq 0 iso 0 dist 9.89583 12.9504 6.03988 10.6914 6.6011 8.94909 numMergedOcc 0
