0 mol 26 unq 0 iso 0 dist 9.97117 9.63803 14.2987 5.3315 6.73162 13.6027 numMergedOcc 0
1 mol 115 unq 0 iso 0 dist 5.58063 8.42219 5.65471 5.24961 7.64585 6.39384 numMergedOcc 0
2 mol 117 unq 0 iso 0 dist 9.58171 6.78655 5.56883 10.4485 6.62561 10.4223 numMergedOcc 0
3 mol 117 unq 1 iso 0 dist 9.58171 6.78655 5.56883 5.27151 7.63616 8.19331 numMergedOcc 0
4 mol 131 unq 0 iso 0 dist 9.90096 9.10434 9.23774 4.29914 8.6243 10.0551 numMergedOcc 0
5 mol 131 unq 1 iso 0 dist 9.90096 9.10434 9.23774 5.59449 6.91348 10.7579 numMergedOcc 0
6 mol 155 unq 0 iso 0 dist 7.62575 7.25009 4.48516 14.7279 9.86313 12.9034 numMergedOcc 0
7 mol 155 unq 1 iso 0 dist 7.62575 7.25009 4.48516 10.4606 7.51198 8.97626 numMergedOcc 0
8 mol 195 unq 0 iso 0 dist 7.63511 8.60546 4.89429 8.97729 8.36117 12.662 numMergedOcc 0
9 mol 219 unq 0 iso 0 dist 7.1158 6.52136 3.78261 5.0241 4.87541 4.33238 numMergedOcc 0
10 mol 222 unq 0 iso 0 dist 7.35476 8.86886 13.6834 4.82768 6.82208 12.0171 numMergedOcc 0
11 mol 227 unq 0 iso 0 dist 8.82471 7.90991 12.1785 10.9746 5.86443 15.5758 numMergedOcc 0
12 mol 233 unq 0 iso 0 dist 7.83363 5.76164 6.80416 12.3957 9.43203 14.726 numMergedOcc 0
13 mol 238 unq 0 iso 0 dist 9.46582 8.56975 9.75095 9.23693 7.67322 9.12776 numMergedOcc 0
14 mol 238 unq 1 iso 0 dist 9.77231 8.56975 11.7938 15.3161 9.68513 11.1002 numMergedOcc 0
15 mol 238 unq 2 iso 0 dist 9.77231 8.56975 11.7938 9.18011 9.29858 9.72188 numMergedOcc 0
16 mol 259 unq 0 iso 0 dist 8.46351 4.95855 4.61451 5.59901 7.76676 6.9899 numMergedOcc 0
17 mol 259 unq 1 iso 0 dist 8.46351 7.72489 5.56602 5.59901 7.76676 10.4017 numMergedOcc 0
18 mol 274 unq 0 iso 0 dist 8.62431 4.97796 5.70568 4.56913 6.50589 6.4611 numMergedOcc 0
19 mol 282 unq 0 iso 0 dist 9.20119 7.60738 5.77779 12.5533 6.85028 12.3763 numMergedOcc 0
20 mol 282 unq 1 iso 0 dist 9.20119 7.60738 5.77779 14.3567 7.32347 12.2771 numMergedOcc 0
21 mol 282 unq 2 iso 0 dist 9.20119 7.60738 5.77779 6.32603 8.3411 10.6699 numMergedOcc 0
