0 mol 28 unq 0 iso 0 dist 8.70005 9.05939 6.20881 7.15351 12.3706 9.4148 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 8.70005 9.38747 11.4016 7.15351 12.3706 6.87842 numMergedOcc 0
2 mol 32 unq 0 iso 0 dist 9.17591 7.13608 6.97536 4.62392 12.5397 8.22628 numMergedOcc 0
3 mol 32 unq 1 iso 0 dist 9.17591 7.13608 6.97536 12.1285 16.5185 9.82819 numMergedOcc 0
4 mol 32 unq 2 iso 0 dist 7.12013 9.46895 8.79217 11.4081 15.0505 8.22628 numMergedOcc 0
5 mol 32 unq 3 iso 0 dist 7.12013 9.46895 8.79217 4.56364 11.029 9.82819 numMergedOcc 0
6 mol 43 unq 0 iso 0 dist 8.58709 7.67459 8.75469 9.50501 14.1389 6.57633 numMergedOcc 0
7 mol 43 unq 1 iso 0 dist 7.53564 7.62469 6.44784 4.9903 10.872 8.21247 numMergedOcc 0
8 mol 68 unq 0 iso 0 dist 8.06263 5.48997 6.94076 11.1122 13.15 7.50377 numMergedOcc 0
9 mol 152 unq 0 iso 0 dist 8.84852 9.27341 7.53439 10.2277 13.3981 7.94976 numMergedOcc 0
10 mol 170 unq 0 iso 0 dist 5.94075 9.15159 7.9212 13.3123 14.9571 8.38932 numMergedOcc 0
11 mol 205 unq 0 iso 0 dist 9.90674 8.63185 4.98206 9.39472 11.5139 8.92597 numMergedOcc 0
12 mol 210 unq 0 iso 0 dist 7.68078 8.94889 12.3142 10.3044 16.939 7.80421 numMergedOcc 0
13 mol 210 unq 1 iso 0 dist 7.68078 8.94889 12.3142 4.3844 8.36019 9.71107 numMergedOcc 0
14 mol 210 unq 2 iso 0 dist 7.68078 8.94889 12.3142 6.85132 7.30805 9.7449 numMergedOcc 0
15 mol 210 unq 3 iso 0 dist 9.26518 8.94889 13.7365 10.3044 13.4046 7.80421 numMergedOcc 0
16 mol 210 unq 4 iso 0 dist 9.26518 8.94889 13.7365 4.3844 13.4699 9.71107 numMergedOcc 0
17 mol 210 unq 5 iso 0 dist 9.26518 8.94889 13.7365 6.85132 16.0649 9.7449 numMergedOcc 0
18 mol 222 unq 0 iso 0 dist 9.5045 5.17916 6.77642 7.60854 14.5977 7.99441 numMergedOcc 0
19 mol 222 unq 1 iso 0 dist 9.5045 5.17916 6.77642 5.13817 13.1173 6.71817 numMergedOcc 0
20 mol 222 unq 2 iso 0 dist 9.5045 5.17916 6.77642 4.54609 13.1334 8.41524 numMergedOcc 0
21 mol 223 unq 0 iso 0 dist 9.86372 7.76053 8.36102 11.7479 17.9562 9.94483 numMergedOcc 0
22 mol 223 unq 1 iso 0 dist 7.70946 7.76053 5.43913 11.7479 14.497 9.94483 numMergedOcc 0
23 mol 224 unq 0 iso 0 dist 9.06201 7.35677 7.83342 10.7796 14.5434 7.92513 numMergedOcc 0
24 mol 235 unq 0 iso 0 dist 7.52696 7.30003 4.81997 7.4921 4.36956 7.93194 numMergedOcc 0
25 mol 249 unq 0 iso 0 dist 6.04688 5.70674 4.88298 6.46947 9.1515 8.56493 numMergedOcc 0
26 mol 267 unq 0 iso 0 dist 5.32643 6.79491 9.17078 9.80917 12.8503 9.58438 numMergedOcc 0
27 mol 281 unq 0 iso 0 dist 9.61122 6.47753 10.2905 12.3104 18.3328 8.90116 numMergedOcc 0
28 mol 281 unq 1 iso 0 dist 9.95684 9.69744 10.2905 16.3183 18.3328 8.90116 numMergedOcc 0
29 mol 283 unq 0 iso 0 dist 6.15136 6.93798 4.67572 5.83652 5.05882 5.32876 numMergedOcc 0
30 mol 283 unq 1 iso 0 dist 6.15136 6.93798 4.67572 5.99759 8.12067 7.60296 numMergedOcc 0
