0 mol 9 unq 0 iso 0 dist 5.2505 4.71717 6.36209 5.84684 9.55873 6.42204 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 9.52295 9.54412 9.97844 4.99287 7.32236 11.2484 numMergedOcc 0
2 mol 53 unq 0 iso 0 dist 4.7864 7.88793 7.92196 5.34876 6.05264 12.6452 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 6.00709 13.255 8.51096 7.47787 6.32539 13.9699 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 6.59983 7.86899 5.13951 4.85985 7.89895 9.47129 numMergedOcc 0
5 mol 68 unq 1 iso 0 dist 9.92579 7.86899 5.88852 4.85985 9.54996 9.47129 numMergedOcc 0
6 mol 68 unq 2 iso 0 dist 9.12636 12.5641 5.13951 4.6006 7.89895 9.47129 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 7.70787 9.42024 6.00779 5.89334 9.8821 14.0481 numMergedOcc 0
8 mol 73 unq 1 iso 0 dist 7.70787 9.42024 6.00779 6.63464 8.80003 13.2461 numMergedOcc 0
9 mol 73 unq 2 iso 0 dist 9.57191 10.3721 5.52283 10.1688 8.40154 6.87319 numMergedOcc 0
10 mol 120 unq 0 iso 0 dist 9.13829 6.87017 5.94417 7.77274 6.14769 9.18392 numMergedOcc 0
11 mol 120 unq 1 iso 0 dist 6.84082 6.87017 7.48283 7.77274 8.02616 9.18392 numMergedOcc 0
12 mol 120 unq 2 iso 0 dist 8.66256 10.0173 7.48283 10.778 8.02616 9.18392 numMergedOcc 0
13 mol 120 unq 3 iso 0 dist 5.90276 5.23504 5.94417 4.95 6.14769 9.18392 numMergedOcc 0
14 mol 120 unq 4 iso 0 dist 8.08194 5.23504 7.48283 4.95 8.02616 9.18392 numMergedOcc 0
15 mol 120 unq 5 iso 0 dist 9.89622 12.6234 7.48283 4.88697 8.02616 9.18392 numMergedOcc 0
16 mol 120 unq 6 iso 0 dist 8.565 13.9931 5.94417 8.23429 6.14769 9.18392 numMergedOcc 0
17 mol 154 unq 0 iso 0 dist 9.19804 10.8705 9.58365 15.6506 9.2828 11.7272 numMergedOcc 0
18 mol 176 unq 0 iso 0 dist 8.00931 9.95814 8.69001 4.84752 5.61752 6.06965 numMergedOcc 0
19 mol 176 unq 1 iso 0 dist 9.65262 9.68914 8.69001 8.80777 5.61752 6.06965 numMergedOcc 0
20 mol 218 unq 0 iso 0 dist 6.02521 5.24297 9.27398 5.77737 9.94807 10.0598 numMergedOcc 0
21 mol 220 unq 0 iso 0 dist 6.94771 14.8054 8.81279 4.74145 7.01486 14.6666 numMergedOcc 0
22 mol 220 unq 1 iso 0 dist 6.94771 14.8054 8.81279 3.57693 8.86569 15.1244 numMergedOcc 0
23 mol 220 unq 2 iso 0 dist 6.94771 14.8054 8.81279 9.46392 9.06824 10.3793 numMergedOcc 0
24 mol 220 unq 3 iso 0 dist 6.94771 12.6024 9.57951 4.74145 7.01486 11.4142 numMergedOcc 0
25 mol 220 unq 4 iso 0 dist 6.94771 12.6024 9.57951 3.57693 8.86569 12.139 numMergedOcc 0
26 mol 220 unq 5 iso 0 dist 6.94771 12.6024 9.57951 9.46392 9.06824 9.51851 numMergedOcc 0
27 mol 242 unq 0 iso 0 dist 8.75712 9.37076 8.90437 5.22346 5.97464 4.99882 numMergedOcc 0
28 mol 249 unq 0 iso 0 dist 5.68936 6.1946 9.91722 7.08836 5.89339 8.03276 numMergedOcc 0
29 mol 283 unq 0 iso 0 dist 7.81415 12.3631 5.7378 4.01355 4.1631 8.51629 numMergedOcc 0
30 mol 283 unq 1 iso 0 dist 7.81415 5.49773 7.15632 4.01355 4.1631 4.67572 numMergedOcc 0
