0 mol 26 unq 0 iso 0 dist 8.06929 4.76147 5.69955 7.56492 6.73167 8.25132 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 8.06929 4.76147 5.69955 9.32305 7.40948 4.94205 numMergedOcc 0
2 mol 26 unq 2 iso 0 dist 8.06929 12.2574 8.6385 7.56492 6.73167 7.73394 numMergedOcc 0
3 mol 26 unq 3 iso 0 dist 8.06929 12.2574 8.6385 9.32305 7.40948 7.42064 numMergedOcc 0
4 mol 26 unq 4 iso 0 dist 8.58514 5.93227 5.69955 13.5965 6.73167 8.25132 numMergedOcc 0
5 mol 26 unq 5 iso 0 dist 8.58514 5.93227 5.69955 5.90891 7.40948 4.94205 numMergedOcc 0
6 mol 26 unq 6 iso 0 dist 8.58514 12.8213 8.6385 13.5965 6.73167 7.73394 numMergedOcc 0
7 mol 26 unq 7 iso 0 dist 8.58514 12.8213 8.6385 5.90891 7.40948 7.42064 numMergedOcc 0
8 mol 51 unq 0 iso 0 dist 9.26014 6.4918 7.76282 5.37196 7.40639 4.146 numMergedOcc 0
9 mol 53 unq 0 iso 0 dist 9.99188 10.2062 7.09169 6.79663 6.2676 9.22034 numMergedOcc 0
10 mol 58 unq 0 iso 0 dist 8.98939 8.89982 7.27383 6.45595 6.87028 4.00553 numMergedOcc 0
11 mol 92 unq 0 iso 0 dist 8.53164 9.40516 6.49956 8.96364 7.0561 4.3481 numMergedOcc 0
12 mol 93 unq 0 iso 0 dist 7.46327 12.3373 9.81831 8.99253 7.8435 16.1023 numMergedOcc 0
13 mol 93 unq 1 iso 0 dist 7.46327 12.3373 9.81831 3.78587 5.99269 13.1721 numMergedOcc 0
14 mol 93 unq 2 iso 0 dist 7.46327 12.3373 9.81831 10.5386 5.71763 9.34182 numMergedOcc 0
15 mol 93 unq 3 iso 0 dist 7.46327 11.6592 9.12858 8.99253 7.8435 12.4934 numMergedOcc 0
16 mol 93 unq 4 iso 0 dist 7.46327 11.6592 9.12858 3.78587 5.99269 11.0537 numMergedOcc 0
17 mol 93 unq 5 iso 0 dist 7.46327 11.6592 9.12858 10.5386 5.71763 12.0103 numMergedOcc 0
18 mol 93 unq 6 iso 0 dist 7.46327 6.09816 9.4523 8.99253 7.8435 10.8106 numMergedOcc 0
19 mol 93 unq 7 iso 0 dist 7.46327 6.09816 9.4523 3.78587 5.99269 7.14217 numMergedOcc 0
20 mol 93 unq 8 iso 0 dist 7.46327 6.09816 9.4523 10.5386 5.71763 12.9351 numMergedOcc 0
21 mol 103 unq 0 iso 0 dist 9.67785 6.2092 9.44561 3.98194 6.46343 4.65519 numMergedOcc 0
22 mol 141 unq 0 iso 0 dist 8.92412 4.37081 6.69515 15.6403 6.77921 13.2918 numMergedOcc 0
23 mol 141 unq 1 iso 0 dist 8.92412 6.23566 7.86572 15.6403 6.77921 13.4066 numMergedOcc 0
24 mol 141 unq 2 iso 0 dist 6.97579 10.5394 6.69515 6.90735 6.77921 13.2918 numMergedOcc 0
25 mol 141 unq 3 iso 0 dist 6.97579 12.1215 7.86572 6.90735 6.77921 13.4066 numMergedOcc 0
26 mol 147 unq 0 iso 0 dist 9.60646 8.07266 5.49226 10.7996 9.43989 12.068 numMergedOcc 0
27 mol 147 unq 1 iso 0 dist 9.60646 5.83569 6.28351 10.7996 9.43989 5.59468 numMergedOcc 0
28 mol 171 unq 0 iso 0 dist 8.2866 5.64994 9.11712 7.35732 8.999 4.00127 numMergedOcc 0
29 mol 178 unq 0 iso 0 dist 8.56251 4.51874 4.92088 4.00111 8.25282 6.42973 numMergedOcc 0
30 mol 186 unq 0 iso 0 dist 9.67802 18.5326 9.83476 11.7817 7.04815 13.6744 numMergedOcc 0
31 mol 186 unq 1 iso 0 dist 9.67802 18.5326 9.83476 5.74741 6.07389 15.0914 numMergedOcc 0
32 mol 186 unq 2 iso 0 dist 9.18314 7.37734 9.83476 13.8203 7.04815 13.6744 numMergedOcc 0
33 mol 186 unq 3 iso 0 dist 9.18314 7.37734 9.83476 12.4955 6.07389 15.0914 numMergedOcc 0
34 mol 195 unq 0 iso 0 dist 9.96728 7.24106 6.60567 9.71052 6.34234 5.41635 numMergedOcc 0
35 mol 195 unq 1 iso 0 dist 9.96728 7.24106 6.60567 10.1093 7.87972 11.9954 numMergedOcc 0
36 mol 195 unq 2 iso 0 dist 9.96728 12.7239 7.62942 9.71052 6.34234 6.04871 numMergedOcc 0
37 mol 195 unq 3 iso 0 dist 9.96728 12.7239 7.62942 10.1093 7.87972 8.04534 numMergedOcc 0
38 mol 196 unq 0 iso 0 dist 5.89229 4.33607 8.20691 6.95386 6.25813 6.29158 numMergedOcc 0
39 mol 212 unq 0 iso 0 dist 6.73307 6.11277 8.57827 8.99365 5.50658 6.47488 numMergedOcc 0
40 mol 212 unq 1 iso 0 dist 6.73307 6.98531 6.29767 8.99365 5.50658 3.9436 numMergedOcc 0
41 mol 218 unq 0 iso 0 dist 4.57726 6.66456 8.86175 7.89755 8.04838 3.8877 numMergedOcc 0
42 mol 218 unq 1 iso 0 dist 4.57726 5.09263 6.29511 7.89755 8.04838 6.0516 numMergedOcc 0
43 mol 252 unq 0 iso 0 dist 7.82138 7.66494 6.11473 6.96456 9.39658 5.6214 numMergedOcc 0
44 mol 252 unq 1 iso 0 dist 9.27529 7.66494 6.53679 6.96456 5.9974 5.6214 numMergedOcc 0
45 mol 252 unq 2 iso 0 dist 9.27529 12.8993 7.50201 6.96456 5.9974 7.40852 numMergedOcc 0
46 mol 266 unq 0 iso 0 dist 7.92391 4.97892 7.71657 6.11441 8.20485 4.74189 numMergedOcc 0
47 mol 279 unq 0 iso 0 dist 8.31175 9.86167 8.29305 7.20921 5.8304 6.5644 numMergedOcc 0
48 mol 279 unq 1 iso 0 dist 8.31175 9.86167 8.29305 13.1821 7.37478 8.70069 numMergedOcc 0
49 mol 279 unq 2 iso 0 dist 8.31175 9.59818 6.43341 7.20921 5.8304 9.40912 numMergedOcc 0
50 mol 279 unq 3 iso 0 dist 8.31175 9.59818 6.43341 13.1821 7.37478 4.14939 numMergedOcc 0
