0 mol 7 unq 0 iso 0 dist 8.41585 6.81066 10.6 9.87885 12.8323 8.80913 10.2446 7.88043 12.1093 8.15894 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.41585 6.81066 10.6 9.87885 12.8323 8.80913 12.3097 8.80762 11.3894 8.45544 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 8.57077 7.38017 10.6533 8.55451 8.69454 5.53745 3.98483 9.78006 6.20227 9.64824 numMergedOcc 0
3 mol 9 unq 1 iso 0 dist 8.57077 7.38017 10.6533 5.8245 5.84314 5.48345 3.98483 9.78006 6.20227 7.05919 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 8.86116 6.07553 5.86882 8.09311 11.6226 6.32709 5.97304 6.60423 5.47982 10.8583 numMergedOcc 0
5 mol 24 unq 1 iso 0 dist 8.86116 6.07553 5.86882 9.05357 13.1949 11.6058 5.97304 6.60423 5.47982 14.2818 numMergedOcc 0
6 mol 24 unq 2 iso 0 dist 8.86116 6.48457 9.9259 8.09311 11.6226 13.862 5.97304 6.60423 9.16583 10.8583 numMergedOcc 0
7 mol 24 unq 3 iso 0 dist 8.86116 6.48457 9.9259 9.05357 13.1949 9.94168 5.97304 6.60423 9.16583 14.2818 numMergedOcc 0
8 mol 43 unq 0 iso 0 dist 5.73819 9.07906 8.42544 6.75943 4.96926 11.2174 5.48048 8.44903 14.341 7.15901 numMergedOcc 0
9 mol 85 unq 0 iso 0 dist 7.95579 8.81824 6.62562 7.7068 6.36397 9.85117 5.08358 8.00777 6.00564 10.7316 numMergedOcc 0
10 mol 85 unq 1 iso 0 dist 6.19965 8.81824 5.46695 7.7068 4.41789 9.85117 5.08358 7.1589 6.00564 10.7316 numMergedOcc 0
11 mol 152 unq 0 iso 0 dist 5.87555 8.86966 8.18329 6.70693 4.94983 10.8368 5.59336 8.35555 14.1528 7.1069 numMergedOcc 0
12 mol 175 unq 0 iso 0 dist 9.29945 6.62757 13.4456 9.63417 11.0361 13.041 4.24624 8.0154 6.59925 12.349 numMergedOcc 0
13 mol 175 unq 1 iso 0 dist 9.29945 9.36354 14.5359 9.63417 11.0361 5.71279 4.24624 8.0154 12.5175 12.349 numMergedOcc 0
14 mol 178 unq 0 iso 0 dist 6.69288 8.4173 4.43082 7.06025 6.42973 7.86021 10.1489 4.92088 8.78897 8.25282 numMergedOcc 0
15 mol 192 unq 0 iso 0 dist 5.59424 8.63044 10.375 9.78634 9.53265 9.64278 7.0057 7.24199 11.7104 15.493 numMergedOcc 0
16 mol 192 unq 1 iso 0 dist 5.59424 8.63044 10.375 5.64942 6.35474 10.8255 7.0057 7.24199 11.7104 11.7494 numMergedOcc 0
17 mol 192 unq 2 iso 0 dist 5.59424 8.63044 10.375 7.43054 5.25965 12.9782 7.0057 7.24199 11.7104 11.7133 numMergedOcc 0
18 mol 205 unq 0 iso 0 dist 6.03031 7.23959 9.73907 6.52816 9.49403 5.19623 5.28092 8.44861 7.85966 10.183 numMergedOcc 0
19 mol 205 unq 1 iso 0 dist 7.26832 7.23959 12.3578 6.52816 13.514 5.19623 5.28092 5.60393 7.85966 10.183 numMergedOcc 0
20 mol 224 unq 0 iso 0 dist 6.61986 7.80754 4.32714 8.08349 5.13732 9.06907 4.59567 8.37597 10.9543 8.54702 numMergedOcc 0
21 mol 224 unq 1 iso 0 dist 6.61986 8.20295 8.95149 8.08349 5.13732 13.4882 4.59567 8.37597 11.5065 8.54702 numMergedOcc 0
22 mol 252 unq 0 iso 0 dist 7.19638 7.48298 6.56535 7.15764 7.40852 9.49612 7.63376 7.50201 12.3574 5.9974 numMergedOcc 0
23 mol 252 unq 1 iso 0 dist 7.19638 8.9483 4.51829 7.15764 7.40852 10.6529 7.63376 7.50201 11.8392 5.9974 numMergedOcc 0
