0 mol 7 unq 0 iso 0 dist 8.77133 6.15313 9.97624 12.1991 13.0969 6.14469 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 6.56599 12.6523 9.09091 11.9176 8.17605 7.98326 numMergedOcc 0
2 mol 11 unq 1 iso 0 dist 6.56599 12.6523 9.09091 18.2035 12.9594 7.90478 numMergedOcc 0
3 mol 11 unq 2 iso 0 dist 6.35021 12.8869 8.73067 11.6776 7.5901 7.98326 numMergedOcc 0
4 mol 11 unq 3 iso 0 dist 6.35021 12.8869 8.73067 18.0017 12.5553 7.46578 numMergedOcc 0
5 mol 15 unq 0 iso 0 dist 9.11751 7.11548 6.50647 8.37378 6.19131 6.03257 numMergedOcc 0
6 mol 26 unq 0 iso 0 dist 7.24149 5.60332 7.22361 10.2205 7.52321 7.35861 numMergedOcc 0
7 mol 26 unq 1 iso 0 dist 8.63881 5.60332 6.15893 10.2205 7.26595 7.35861 numMergedOcc 0
8 mol 26 unq 2 iso 0 dist 8.63881 7.30207 5.497 11.2685 11.553 6.56527 numMergedOcc 0
9 mol 26 unq 3 iso 0 dist 9.33901 5.3241 6.15893 10.1981 7.26595 7.35861 numMergedOcc 0
10 mol 26 unq 4 iso 0 dist 9.33901 6.30968 5.497 10.1279 11.553 6.56527 numMergedOcc 0
11 mol 73 unq 0 iso 0 dist 6.96647 5.00474 7.10439 13.1749 9.79695 8.87464 numMergedOcc 0
12 mol 79 unq 0 iso 0 dist 8.17967 9.40625 9.63599 5.33546 6.49291 9.78384 numMergedOcc 0
13 mol 79 unq 1 iso 0 dist 8.17967 9.40625 9.63599 16.4082 11.51 8.87742 numMergedOcc 0
14 mol 79 unq 2 iso 0 dist 8.17967 9.40625 9.63599 10.5396 7.82761 4.93468 numMergedOcc 0
15 mol 114 unq 0 iso 0 dist 9.9778 9.72019 6.13559 9.58855 11.1434 8.42878 numMergedOcc 0
16 mol 114 unq 1 iso 0 dist 6.27701 9.72019 6.51395 9.58855 4.41568 8.42878 numMergedOcc 0
17 mol 114 unq 2 iso 0 dist 6.06039 11.1547 9.83981 19.1341 16.0864 8.42878 numMergedOcc 0
18 mol 114 unq 3 iso 0 dist 9.36502 11.1547 6.13559 19.1341 11.1434 8.42878 numMergedOcc 0
19 mol 116 unq 0 iso 0 dist 9.49798 6.2875 7.35992 6.74026 6.10081 8.38606 numMergedOcc 0
20 mol 116 unq 1 iso 0 dist 8.31955 6.2875 6.49383 6.74026 4.94926 8.38606 numMergedOcc 0
21 mol 141 unq 0 iso 0 dist 6.27859 4.1584 4.25566 13.1958 7.64948 9.83945 numMergedOcc 0
22 mol 141 unq 1 iso 0 dist 6.27859 9.5453 7.31037 13.1958 7.64948 6.75376 numMergedOcc 0
23 mol 141 unq 2 iso 0 dist 6.28535 4.1584 6.63171 13.1958 14.2837 9.83945 numMergedOcc 0
24 mol 181 unq 0 iso 0 dist 7.39743 9.06982 8.9289 15.7398 15.9559 7.22883 numMergedOcc 0
25 mol 232 unq 0 iso 0 dist 9.94653 5.0625 7.10413 11.097 10.9886 9.78181 numMergedOcc 0
26 mol 232 unq 1 iso 0 dist 7.97572 4.86592 7.10413 13.5987 10.9886 9.78181 numMergedOcc 0
27 mol 238 unq 0 iso 0 dist 9.61559 7.39114 7.04753 11.0357 9.71156 5.92374 numMergedOcc 0
28 mol 250 unq 0 iso 0 dist 9.45903 8.13148 5.97993 5.92578 7.73342 9.70149 numMergedOcc 0
29 mol 250 unq 1 iso 0 dist 8.51531 8.13148 6.44252 5.92578 5.66455 9.70149 numMergedOcc 0
30 mol 271 unq 0 iso 0 dist 8.6344 4.17949 5.81266 6.85471 4.51983 5.92274 numMergedOcc 0
