0 mol 11 unq 0 iso 0 dist 9.07476 5.23547 9.89425 9.52695 6.76736 6.859 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 7.79911 10.0857 9.58192 10.5799 4.11146 9.85784 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 7.36836 6.99091 7.34832 12.969 9.10687 8.96684 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 8.18214 6.4113 5.64092 7.07989 3.99506 7.98985 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 7.06029 10.0025 9.04293 11.9711 5.84075 9.77084 numMergedOcc 0
5 mol 79 unq 1 iso 0 dist 7.06029 6.35003 4.78333 11.9711 5.84075 6.5551 numMergedOcc 0
6 mol 93 unq 0 iso 0 dist 5.10693 3.91263 6.67678 9.82649 5.64998 9.19977 numMergedOcc 0
7 mol 93 unq 1 iso 0 dist 5.10693 3.91263 6.67678 7.4518 4.34681 7.28831 numMergedOcc 0
8 mol 93 unq 2 iso 0 dist 5.10693 3.91263 6.67678 9.1687 9.11796 9.71411 numMergedOcc 0
9 mol 93 unq 3 iso 0 dist 6.58814 3.91263 7.24956 9.82649 4.76749 9.19977 numMergedOcc 0
10 mol 93 unq 4 iso 0 dist 6.58814 3.91263 7.24956 7.4518 5.73248 7.28831 numMergedOcc 0
11 mol 93 unq 5 iso 0 dist 6.58814 3.91263 7.24956 9.1687 7.24672 9.71411 numMergedOcc 0
12 mol 93 unq 6 iso 0 dist 6.13459 3.91263 8.28591 9.82649 15.6931 9.19977 numMergedOcc 0
13 mol 93 unq 7 iso 0 dist 6.13459 3.91263 8.28591 7.4518 13.5809 7.28831 numMergedOcc 0
14 mol 93 unq 8 iso 0 dist 6.13459 3.91263 8.28591 9.1687 10.6039 9.71411 numMergedOcc 0
15 mol 93 unq 9 iso 0 dist 7.54391 3.91263 9.40687 9.82649 14.8662 9.19977 numMergedOcc 0
16 mol 93 unq 10 iso 0 dist 7.54391 3.91263 9.40687 7.4518 14.149 7.28831 numMergedOcc 0
17 mol 93 unq 11 iso 0 dist 7.54391 3.91263 9.40687 9.1687 6.48338 9.71411 numMergedOcc 0
18 mol 113 unq 0 iso 0 dist 7.96893 8.60362 8.67025 9.66068 6.29259 9.30645 numMergedOcc 0
19 mol 168 unq 0 iso 0 dist 6.48066 9.43003 7.0961 12.1714 7.27069 9.85438 numMergedOcc 0
20 mol 168 unq 1 iso 0 dist 6.48066 8.01699 8.21227 12.1714 7.27069 9.42807 numMergedOcc 0
21 mol 168 unq 2 iso 0 dist 8.47543 6.97182 8.26768 11.7086 4.51252 9.85438 numMergedOcc 0
22 mol 169 unq 0 iso 0 dist 7.33643 14.6592 9.06172 9.43938 5.68902 6.0859 numMergedOcc 0
23 mol 169 unq 1 iso 0 dist 7.33643 14.6592 9.06172 5.51388 3.83687 9.15283 numMergedOcc 0
24 mol 169 unq 2 iso 0 dist 7.33643 14.9735 8.93091 9.43938 5.68902 6.05009 numMergedOcc 0
25 mol 184 unq 0 iso 0 dist 9.10344 6.60692 7.25623 8.95598 5.69882 7.81263 numMergedOcc 0
26 mol 186 unq 0 iso 0 dist 7.69952 6.21273 8.17928 15.5743 14.2269 9.45907 numMergedOcc 0
27 mol 194 unq 0 iso 0 dist 8.76748 3.86206 6.68939 8.03512 9.87573 9.32959 numMergedOcc 0
28 mol 194 unq 1 iso 0 dist 8.76748 3.86206 6.68939 10.0521 6.97562 8.64056 numMergedOcc 0
29 mol 205 unq 0 iso 0 dist 8.25174 7.54616 7.4185 10.9338 5.27881 8.31721 numMergedOcc 0
30 mol 205 unq 1 iso 0 dist 9.16671 3.69062 7.4185 10.5525 5.27881 8.31721 numMergedOcc 0
31 mol 222 unq 0 iso 0 dist 4.90656 4.91709 8.88902 5.89818 3.98604 8.43195 numMergedOcc 0
32 mol 260 unq 0 iso 0 dist 7.88108 9.0549 8.51564 5.68717 3.60349 6.75725 numMergedOcc 0
33 mol 260 unq 1 iso 0 dist 9.46576 6.73886 7.49606 5.68717 7.28821 9.31888 numMergedOcc 0
34 mol 278 unq 0 iso 0 dist 9.93392 3.86293 9.67239 6.81257 6.89604 9.03998 numMergedOcc 0
35 mol 278 unq 1 iso 0 dist 9.93392 3.86293 9.67239 10.9277 10.7788 7.67837 numMergedOcc 0
