0 mol 26 unq 0 iso 0 dist 6.67455 9.7522 5.71065 8.99751 5.60332 10.797 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 6.67455 9.7522 5.71065 9.44507 7.30207 10.9837 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 9.84967 5.5814 8.81758 8.51496 10.8606 8.32637 numMergedOcc 0
3 mol 63 unq 0 iso 0 dist 7.09184 8.94945 8.95233 8.51942 7.85496 15.1493 numMergedOcc 0
4 mol 64 unq 0 iso 0 dist 9.82294 8.99491 5.9853 6.23138 8.95689 6.21578 numMergedOcc 0
5 mol 65 unq 0 iso 0 dist 5.98248 8.76461 8.52876 5.83149 4.04864 5.51708 numMergedOcc 0
6 mol 69 unq 0 iso 0 dist 7.30652 5.47319 7.0643 8.91502 4.94886 5.83934 numMergedOcc 0
7 mol 69 unq 1 iso 0 dist 7.30652 9.8809 15.5982 8.91502 4.94886 14.3583 numMergedOcc 0
8 mol 112 unq 0 iso 0 dist 5.81553 5.17585 4.87668 8.23777 6.74235 5.76098 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 9.73038 9.50322 5.34829 6.72323 12.9623 12.538 numMergedOcc 0
10 mol 133 unq 1 iso 0 dist 9.73038 5.82404 9.67676 6.72323 12.9623 4.54648 numMergedOcc 0
11 mol 157 unq 0 iso 0 dist 8.78412 6.1835 6.91388 9.30128 6.22449 8.0238 numMergedOcc 0
12 mol 157 unq 1 iso 0 dist 8.78412 6.1835 6.91388 9.04487 10.8634 6.41986 numMergedOcc 0
13 mol 162 unq 0 iso 0 dist 9.74749 9.97921 6.22059 8.63323 4.05981 6.07158 numMergedOcc 0
14 mol 169 unq 0 iso 0 dist 6.09291 9.46833 6.21354 7.91434 7.70397 4.62636 numMergedOcc 0
15 mol 169 unq 1 iso 0 dist 6.09291 9.46833 6.21354 7.79437 4.8154 5.81985 numMergedOcc 0
16 mol 175 unq 0 iso 0 dist 8.57666 8.58906 5.34813 7.42278 10.4516 7.68909 numMergedOcc 0
17 mol 205 unq 0 iso 0 dist 9.85777 6.752 12.019 7.23557 10.0824 5.8535 numMergedOcc 0
18 mol 205 unq 1 iso 0 dist 8.47833 6.752 5.58339 7.23557 11.1448 5.8535 numMergedOcc 0
19 mol 205 unq 2 iso 0 dist 5.05912 6.752 4.37383 7.23557 5.00854 5.8535 numMergedOcc 0
20 mol 205 unq 3 iso 0 dist 5.47586 8.10287 7.78052 8.86587 11.1448 14.0496 numMergedOcc 0
21 mol 205 unq 4 iso 0 dist 5.47586 5.4913 5.58339 8.86587 11.1448 5.8535 numMergedOcc 0
22 mol 205 unq 5 iso 0 dist 6.60429 8.10287 13.0749 8.86587 5.00854 14.0496 numMergedOcc 0
23 mol 205 unq 6 iso 0 dist 6.60429 5.4913 4.37383 8.86587 5.00854 5.8535 numMergedOcc 0
24 mol 210 unq 0 iso 0 dist 5.70065 8.62103 5.4508 9.26092 5.4402 10.4168 numMergedOcc 0
25 mol 222 unq 0 iso 0 dist 4.87053 7.85877 9.84386 5.89818 4.07008 7.75656 numMergedOcc 0
26 mol 222 unq 1 iso 0 dist 4.87053 7.85877 9.84386 9.32543 10.3765 16.0949 numMergedOcc 0
27 mol 244 unq 0 iso 0 dist 9.06357 7.65388 16.3995 5.79898 14.3408 5.17744 numMergedOcc 0
28 mol 287 unq 0 iso 0 dist 9.38187 7.26542 11.2254 8.42076 5.1517 13.2859 numMergedOcc 0
29 mol 288 unq 0 iso 0 dist 9.38187 7.26542 11.2254 8.42076 5.1517 13.2859 numMergedOcc 0
30 mol 289 unq 0 iso 0 dist 9.38187 7.26542 11.2254 8.42076 5.1517 13.2859 numMergedOcc 0
