0 mol 8 unq 0 iso 0 dist 6.68091 4.04843 8.68949 12.0426 10.8849 9.42634 numMergedOcc 0
1 mol 10 unq 0 iso 0 dist 9.1125 4.55975 8.03458 9.23414 4.37568 9.97671 numMergedOcc 0
2 mol 10 unq 1 iso 0 dist 9.1125 11.8229 8.2106 9.6309 7.54307 9.9373 numMergedOcc 0
3 mol 10 unq 2 iso 0 dist 9.1125 11.8229 8.2106 9.23414 4.37568 7.83087 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 7.5203 6.20447 8.68012 15.5888 13.2059 9.99145 numMergedOcc 0
5 mol 48 unq 0 iso 0 dist 8.05728 9.57046 9.40644 13.1965 8.12843 7.33788 numMergedOcc 0
6 mol 48 unq 1 iso 0 dist 8.05728 9.57046 9.40644 13.6682 9.72202 9.74351 numMergedOcc 0
7 mol 48 unq 2 iso 0 dist 8.05728 9.57046 9.40644 15.1881 12.7252 7.36877 numMergedOcc 0
8 mol 48 unq 3 iso 0 dist 8.05728 4.91237 5.35252 13.1965 8.12843 8.52681 numMergedOcc 0
9 mol 48 unq 4 iso 0 dist 8.05728 4.91237 5.35252 13.6682 9.72202 9.98769 numMergedOcc 0
10 mol 63 unq 0 iso 0 dist 9.1662 3.86843 6.49343 10.0461 4.44607 6.42443 numMergedOcc 0
11 mol 67 unq 0 iso 0 dist 8.34804 5.66613 5.80736 8.4702 8.43533 9.10001 numMergedOcc 0
12 mol 87 unq 0 iso 0 dist 9.4868 15.7737 9.90256 22.1683 13.3292 9.20673 numMergedOcc 0
13 mol 101 unq 0 iso 0 dist 7.22737 6.01775 7.1859 6.67863 4.4529 7.33426 numMergedOcc 0
14 mol 127 unq 0 iso 0 dist 5.52891 6.87376 5.83719 8.94636 3.75302 8.95465 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 9.96416 5.9683 5.79195 14.0737 4.37065 8.98028 numMergedOcc 0
16 mol 133 unq 1 iso 0 dist 7.17051 5.9683 9.2759 14.0737 15.7191 8.98028 numMergedOcc 0
17 mol 133 unq 2 iso 0 dist 5.9962 5.9683 8.76088 14.0737 13.5318 8.98028 numMergedOcc 0
18 mol 133 unq 3 iso 0 dist 8.61448 13.8877 8.76088 19.1179 13.5318 8.98028 numMergedOcc 0
19 mol 176 unq 0 iso 0 dist 8.49376 8.23203 7.98755 14.8525 9.23654 9.40138 numMergedOcc 0
20 mol 176 unq 1 iso 0 dist 6.9705 4.84752 7.98755 11.5221 9.23654 9.40138 numMergedOcc 0
21 mol 188 unq 0 iso 0 dist 8.94864 9.77899 8.1907 13.3673 8.6599 7.50005 numMergedOcc 0
22 mol 205 unq 0 iso 0 dist 7.55333 6.67537 5.86839 10.0133 4.51847 4.93303 numMergedOcc 0
23 mol 205 unq 1 iso 0 dist 7.55333 6.67537 5.86839 9.16671 10.9814 9.95859 numMergedOcc 0
24 mol 244 unq 0 iso 0 dist 9.53211 4.30655 7.79787 12.41 4.80974 9.45199 numMergedOcc 0
25 mol 244 unq 1 iso 0 dist 9.53211 4.30655 7.79787 12.0503 13.59 9.07512 numMergedOcc 0
26 mol 265 unq 0 iso 0 dist 9.81689 10.531 7.52632 12.6665 10.5232 6.04835 numMergedOcc 0
27 mol 268 unq 0 iso 0 dist 8.43164 6.35006 5.94741 8.6577 5.39453 5.49906 numMergedOcc 0
28 mol 271 unq 0 iso 0 dist 6.75395 5.60228 9.50884 14.1093 12.9579 9.97897 numMergedOcc 0
29 mol 277 unq 0 iso 0 dist 6.70414 12.5633 8.15119 5.11998 5.11865 9.07744 numMergedOcc 0
30 mol 294 unq 0 iso 0 dist 5.71656 8.43044 9.22572 7.48987 5.13965 8.83359 numMergedOcc 0
