0 mol 1 unq 0 iso 0 dist 8.3673 8.83387 9.67796 6.28655 5.96833 12.6414 numMergedOcc 0
1 mol 15 unq 0 iso 0 dist 9.60736 7.57076 10.6969 6.66625 9.51568 13.3462 numMergedOcc 0
2 mol 32 unq 0 iso 0 dist 8.33273 7.52145 6.37026 11.3911 8.74576 10.9253 numMergedOcc 0
3 mol 32 unq 1 iso 0 dist 9.16481 8.35776 5.33785 7.70136 9.65897 5.9972 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 7.61802 7.32472 12.7313 6.68767 5.91068 9.56614 numMergedOcc 0
5 mol 58 unq 0 iso 0 dist 7.63443 8.96181 4.72216 6.1599 7.60018 5.48837 numMergedOcc 0
6 mol 58 unq 1 iso 0 dist 5.40287 8.96181 5.77163 6.1599 7.03126 5.48837 numMergedOcc 0
7 mol 58 unq 2 iso 0 dist 5.40287 8.96181 5.77163 11.2024 9.68228 13.9198 numMergedOcc 0
8 mol 88 unq 0 iso 0 dist 5.90605 5.43098 5.70431 5.25762 5.28732 4.70557 numMergedOcc 0
9 mol 88 unq 1 iso 0 dist 5.90605 9.40555 5.46288 5.25762 5.28732 10.5092 numMergedOcc 0
10 mol 135 unq 0 iso 0 dist 8.55869 5.60595 4.98191 8.30838 9.09753 9.94534 numMergedOcc 0
11 mol 135 unq 1 iso 0 dist 6.65965 5.60595 5.83178 8.30838 7.6337 9.94534 numMergedOcc 0
12 mol 182 unq 0 iso 0 dist 6.39008 6.78641 3.53123 7.08648 5.73635 8.98501 numMergedOcc 0
13 mol 248 unq 0 iso 0 dist 6.79869 7.9475 3.56723 4.50926 8.07962 10.1918 numMergedOcc 0
14 mol 260 unq 0 iso 0 dist 8.52702 7.13397 15.6308 4.91827 8.5613 10.0128 numMergedOcc 0
15 mol 260 unq 1 iso 0 dist 8.52702 7.13397 15.6308 8.29529 5.7791 14.7837 numMergedOcc 0
16 mol 260 unq 2 iso 0 dist 8.52702 5.33278 10.6938 4.91827 8.5613 5.30187 numMergedOcc 0
17 mol 260 unq 3 iso 0 dist 8.52702 5.33278 10.6938 8.29529 5.7791 10.3097 numMergedOcc 0
18 mol 283 unq 0 iso 0 dist 5.31969 7.58381 3.34167 4.50624 8.51504 9.66832 numMergedOcc 0
19 mol 287 unq 0 iso 0 dist 7.37164 7.96707 7.98095 6.34541 8.9466 10.7115 numMergedOcc 0
20 mol 288 unq 0 iso 0 dist 7.37164 7.96707 7.98095 6.34541 8.9466 10.7115 numMergedOcc 0
21 mol 289 unq 0 iso 0 dist 7.37164 7.96707 7.98095 6.34541 8.9466 10.7115 numMergedOcc 0
