0 mol 42 unq 0 iso 0 dist 9.50568 8.98545 4.62559 10.2834 5.52834 7.53194 numMergedOcc 0
1 mol 53 unq 0 iso 0 dist 6.86092 9.72637 6.20762 4.79821 6.70095 12.0152 numMergedOcc 0
2 mol 83 unq 0 iso 0 dist 7.6104 6.72584 4.48523 13.468 7.2118 7.69755 numMergedOcc 0
3 mol 83 unq 1 iso 0 dist 7.6104 7.25594 9.79852 13.468 7.2118 11.7964 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 7.75977 6.51132 4.56304 10.7488 8.15664 11.2281 numMergedOcc 0
5 mol 92 unq 1 iso 0 dist 7.75977 8.38986 5.04832 10.7488 8.15664 12.9928 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 6.29879 7.84085 4.63862 6.92975 5.79195 9.35049 numMergedOcc 0
7 mol 133 unq 1 iso 0 dist 6.29879 7.84085 4.63862 6.53637 9.2759 10.3668 numMergedOcc 0
8 mol 133 unq 2 iso 0 dist 6.29879 7.84085 4.63862 11.1722 8.76088 13.1234 numMergedOcc 0
9 mol 167 unq 0 iso 0 dist 6.26373 7.33483 6.87479 4.72853 7.20545 8.43955 numMergedOcc 0
10 mol 187 unq 0 iso 0 dist 9.90752 8.17194 5.57973 9.38569 8.0501 8.78442 numMergedOcc 0
11 mol 204 unq 0 iso 0 dist 9.7707 7.00278 6.42785 11.9869 6.62514 12.104 numMergedOcc 0
12 mol 204 unq 1 iso 0 dist 9.7707 7.00278 6.42785 9.42629 6.20044 8.77524 numMergedOcc 0
13 mol 204 unq 2 iso 0 dist 9.7707 7.00278 6.42785 7.50076 9.41996 10.9304 numMergedOcc 0
14 mol 210 unq 0 iso 0 dist 6.61789 9.72463 4.68656 5.87078 8.05949 7.95917 numMergedOcc 0
15 mol 257 unq 0 iso 0 dist 8.36731 6.19418 3.67174 6.35062 8.09912 8.23073 numMergedOcc 0
16 mol 257 unq 1 iso 0 dist 8.36731 9.81401 4.76602 6.35062 8.09912 11.9032 numMergedOcc 0
17 mol 272 unq 0 iso 0 dist 8.19595 8.3872 5.32967 9.49668 6.69245 9.30035 numMergedOcc 0
18 mol 272 unq 1 iso 0 dist 8.19595 8.3872 5.32967 4.36153 7.90763 9.51185 numMergedOcc 0
19 mol 287 unq 0 iso 0 dist 9.40407 6.17759 4.80377 9.16384 8.40726 9.77996 numMergedOcc 0
20 mol 287 unq 1 iso 0 dist 9.40407 8.20391 3.91371 9.16384 8.40726 6.61308 numMergedOcc 0
21 mol 288 unq 0 iso 0 dist 9.40407 6.17759 4.80377 9.16384 8.40726 9.77996 numMergedOcc 0
22 mol 288 unq 1 iso 0 dist 9.40407 8.20391 3.91371 9.16384 8.40726 6.61308 numMergedOcc 0
23 mol 289 unq 0 iso 0 dist 9.40407 6.17759 4.80377 9.16384 8.40726 9.77996 numMergedOcc 0
24 mol 289 unq 1 iso 0 dist 9.40407 8.20391 3.91371 9.16384 8.40726 6.61308 numMergedOcc 0
