0 mol 11 unq 0 iso 0 dist 9.52695 9.07476 6.76736 5.23547 6.859 9.89425 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 8.67162 6.35779 4.32751 5.46563 12.5091 9.19512 numMergedOcc 0
2 mol 62 unq 1 iso 0 dist 8.79114 6.35779 4.83294 5.46563 13.1416 9.19512 numMergedOcc 0
3 mol 63 unq 0 iso 0 dist 6.88374 9.54314 7.1742 7.78684 11.0636 8.78414 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 7.07989 8.18214 3.99506 6.4113 7.98985 5.64092 numMergedOcc 0
5 mol 69 unq 0 iso 0 dist 8.91502 5.75135 10.4849 4.69809 11.4374 9.08745 numMergedOcc 0
6 mol 93 unq 0 iso 0 dist 7.4518 5.10693 4.34681 3.91263 7.28831 6.67678 numMergedOcc 0
7 mol 93 unq 1 iso 0 dist 7.4518 6.58814 5.73248 3.91263 7.28831 7.24956 numMergedOcc 0
8 mol 93 unq 2 iso 0 dist 7.4518 6.13459 13.5809 3.91263 7.28831 8.28591 numMergedOcc 0
9 mol 93 unq 3 iso 0 dist 7.4518 6.13459 13.5809 5.59024 11.6193 5.35008 numMergedOcc 0
10 mol 93 unq 4 iso 0 dist 7.4518 6.13459 13.5809 12.9872 19.8987 8.30921 numMergedOcc 0
11 mol 93 unq 5 iso 0 dist 7.4518 7.54391 14.149 3.91263 7.28831 9.40687 numMergedOcc 0
12 mol 93 unq 6 iso 0 dist 7.4518 7.54391 14.149 5.59024 11.6193 8.84576 numMergedOcc 0
13 mol 93 unq 7 iso 0 dist 7.4518 7.54391 14.149 12.9872 19.8987 7.39732 numMergedOcc 0
14 mol 93 unq 8 iso 0 dist 9.1687 5.10693 9.11796 3.91263 9.71411 6.67678 numMergedOcc 0
15 mol 93 unq 9 iso 0 dist 9.1687 6.58814 7.24672 3.91263 9.71411 7.24956 numMergedOcc 0
16 mol 93 unq 10 iso 0 dist 9.1687 6.13459 10.6039 3.91263 9.71411 8.28591 numMergedOcc 0
17 mol 93 unq 11 iso 0 dist 9.1687 6.13459 10.6039 5.59024 12.2183 5.35008 numMergedOcc 0
18 mol 93 unq 12 iso 0 dist 9.1687 6.13459 10.6039 12.9872 11.9145 8.30921 numMergedOcc 0
19 mol 93 unq 13 iso 0 dist 9.1687 7.54391 6.48338 3.91263 9.71411 9.40687 numMergedOcc 0
20 mol 93 unq 14 iso 0 dist 9.1687 7.54391 6.48338 5.59024 12.2183 8.84576 numMergedOcc 0
21 mol 93 unq 15 iso 0 dist 9.1687 7.54391 6.48338 12.9872 11.9145 7.39732 numMergedOcc 0
22 mol 113 unq 0 iso 0 dist 9.66068 7.96893 6.29259 8.60362 9.30645 8.67025 numMergedOcc 0
23 mol 113 unq 1 iso 0 dist 8.03783 7.96893 8.17309 8.60362 10.6797 8.67025 numMergedOcc 0
24 mol 120 unq 0 iso 0 dist 8.73484 8.03124 8.87094 4.22448 12.5549 9.98772 numMergedOcc 0
25 mol 169 unq 0 iso 0 dist 5.51388 7.33643 3.83687 14.6592 9.15283 9.06172 numMergedOcc 0
26 mol 169 unq 1 iso 0 dist 5.51388 7.33643 3.83687 14.9735 9.68143 8.93091 numMergedOcc 0
27 mol 169 unq 2 iso 0 dist 8.17917 7.78577 7.83748 8.55252 11.0016 8.6961 numMergedOcc 0
28 mol 169 unq 3 iso 0 dist 7.91434 7.50458 14.0793 6.22697 12.9664 7.65903 numMergedOcc 0
29 mol 169 unq 4 iso 0 dist 7.91434 5.79554 13.629 6.22697 12.9664 5.97653 numMergedOcc 0
30 mol 169 unq 5 iso 0 dist 7.91434 4.22003 11.1464 6.22697 12.9664 7.75523 numMergedOcc 0
31 mol 169 unq 6 iso 0 dist 7.79437 7.50458 14.1141 6.22697 10.1399 7.65903 numMergedOcc 0
32 mol 169 unq 7 iso 0 dist 7.79437 5.79554 13.1539 6.22697 10.1399 5.97653 numMergedOcc 0
33 mol 169 unq 8 iso 0 dist 7.79437 4.22003 11.6489 6.22697 10.1399 7.75523 numMergedOcc 0
34 mol 184 unq 0 iso 0 dist 8.95598 9.10344 5.69882 6.60692 7.81263 7.25623 numMergedOcc 0
35 mol 194 unq 0 iso 0 dist 8.03512 8.76748 9.87573 3.86206 9.32959 6.68939 numMergedOcc 0
36 mol 205 unq 0 iso 0 dist 7.23557 8.93485 9.43113 6.10058 11.992 7.68686 numMergedOcc 0
37 mol 205 unq 1 iso 0 dist 8.86587 5.66636 9.43113 3.50446 11.992 7.68686 numMergedOcc 0
38 mol 222 unq 0 iso 0 dist 5.89818 4.90656 3.98604 4.91709 8.43195 8.88902 numMergedOcc 0
39 mol 222 unq 1 iso 0 dist 9.32543 4.90656 7.99695 4.91709 14.0832 8.88902 numMergedOcc 0
40 mol 260 unq 0 iso 0 dist 5.68717 7.88108 3.60349 9.0549 6.75725 8.51564 numMergedOcc 0
41 mol 260 unq 1 iso 0 dist 5.68717 9.46576 7.28821 17.1277 12.6653 9.73217 numMergedOcc 0
42 mol 260 unq 2 iso 0 dist 5.68717 9.46576 7.28821 6.73886 9.31888 7.49606 numMergedOcc 0
43 mol 260 unq 3 iso 0 dist 5.68717 9.46576 7.28821 11.1586 12.9444 8.06377 numMergedOcc 0
44 mol 278 unq 0 iso 0 dist 6.81257 9.93392 6.89604 3.86293 9.03998 9.67239 numMergedOcc 0
