0 mol 9 unq 0 iso 0 dist 7.47838 8.14998 6.79313 11.8617 7.2707 11.0886 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 7.47838 8.14998 6.79313 9.55673 8.99816 10.9851 numMergedOcc 0
2 mol 9 unq 2 iso 0 dist 7.47838 8.14998 6.79313 6.96891 5.96667 6.59312 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 7.48658 5.42067 7.43075 8.70803 9.81484 11.308 numMergedOcc 0
4 mol 92 unq 1 iso 0 dist 7.48658 5.42067 7.43075 9.52327 5.77527 9.68537 numMergedOcc 0
5 mol 92 unq 2 iso 0 dist 7.48658 5.42067 7.43075 13.093 7.313 14.2319 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 6.05583 9.72387 7.14231 11.9775 6.66076 11.4123 numMergedOcc 0
7 mol 157 unq 0 iso 0 dist 8.97404 8.10592 12.3126 7.24719 9.53818 15.0715 numMergedOcc 0
8 mol 157 unq 1 iso 0 dist 8.97404 8.10592 12.3126 8.0238 5.14587 13.2232 numMergedOcc 0
9 mol 157 unq 2 iso 0 dist 8.97404 8.10592 12.3126 15.6542 8.93257 20.3451 numMergedOcc 0
10 mol 157 unq 3 iso 0 dist 8.97404 8.10592 12.3126 6.41986 7.71842 13.641 numMergedOcc 0
11 mol 157 unq 4 iso 0 dist 6.8364 8.10592 7.35437 8.0238 6.58984 13.2232 numMergedOcc 0
12 mol 181 unq 0 iso 0 dist 8.47008 8.29467 10.8158 5.63555 6.2176 12.0951 numMergedOcc 0
13 mol 198 unq 0 iso 0 dist 5.82585 9.7657 7.49759 9.73871 6.50352 11.6081 numMergedOcc 0
14 mol 206 unq 0 iso 0 dist 5.52084 4.51255 7.29429 4.62682 5.80674 5.17607 numMergedOcc 0
15 mol 237 unq 0 iso 0 dist 8.8949 9.7255 4.29566 10.6582 8.20201 12.0818 numMergedOcc 0
16 mol 237 unq 1 iso 0 dist 8.8949 9.7255 4.29566 13.3834 6.21939 10.0241 numMergedOcc 0
17 mol 256 unq 0 iso 0 dist 9.72168 4.80903 12.6385 11.578 6.65749 14.6286 numMergedOcc 0
18 mol 256 unq 1 iso 0 dist 9.72168 4.80903 12.6385 7.7384 4.73652 11.5655 numMergedOcc 0
19 mol 274 unq 0 iso 0 dist 6.92434 9.83622 4.66257 5.29529 5.0002 9.2199 numMergedOcc 0
