0 mol 26 unq 0 iso 0 dist 5.97065 8.69142 4.98603 7.89671 8.82012 6.46104 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 5.97065 8.69142 4.98603 11.9181 10.9838 7.36856 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 6.21143 9.46449 9.84993 5.40129 10.266 7.23317 numMergedOcc 0
3 mol 184 unq 0 iso 0 dist 7.09847 6.71675 7.4793 4.59843 9.52936 6.42735 numMergedOcc 0
4 mol 195 unq 0 iso 0 dist 8.64561 5.0778 4.65391 4.98231 9.45278 6.95086 numMergedOcc 0
5 mol 205 unq 0 iso 0 dist 6.37411 6.32542 11.9538 9.40714 13.7173 6.03688 numMergedOcc 0
6 mol 213 unq 0 iso 0 dist 4.80429 9.65238 6.17282 7.18317 6.0965 7.37798 numMergedOcc 0
7 mol 213 unq 1 iso 0 dist 6.38872 9.65238 12.1116 7.18317 9.59129 7.37798 numMergedOcc 0
8 mol 234 unq 0 iso 0 dist 7.54327 5.74541 5.70413 5.28657 6.16063 6.30154 numMergedOcc 0
9 mol 235 unq 0 iso 0 dist 6.43838 4.46919 4.29892 6.70342 10.7117 9.55668 numMergedOcc 0
10 mol 235 unq 1 iso 0 dist 6.43838 4.46919 4.29892 5.06584 5.65339 6.95126 numMergedOcc 0
11 mol 235 unq 2 iso 0 dist 9.24964 4.46919 13.128 6.70342 9.58736 9.55668 numMergedOcc 0
12 mol 235 unq 3 iso 0 dist 9.24964 4.46919 13.128 5.06584 12.3562 6.95126 numMergedOcc 0
13 mol 238 unq 0 iso 0 dist 6.50118 6.97527 10.3809 11.1632 12.5477 7.57812 numMergedOcc 0
14 mol 238 unq 1 iso 0 dist 6.50118 6.97527 10.3809 5.18833 9.29858 9.24557 numMergedOcc 0
15 mol 238 unq 2 iso 0 dist 9.3099 6.97527 10.3147 11.1632 9.90142 7.57812 numMergedOcc 0
16 mol 238 unq 3 iso 0 dist 9.3099 6.97527 10.3147 5.18833 10.7386 9.24557 numMergedOcc 0
17 mol 243 unq 0 iso 0 dist 7.96438 7.30188 5.60791 5.8297 11.5253 8.76935 numMergedOcc 0
18 mol 274 unq 0 iso 0 dist 8.38395 6.74022 4.60275 10.7073 12.5979 8.52587 numMergedOcc 0
19 mol 274 unq 1 iso 0 dist 8.38395 6.74022 4.60275 6.45522 9.19234 6.39866 numMergedOcc 0
20 mol 280 unq 0 iso 0 dist 6.78323 9.35785 4.12456 10.6459 11.1057 9.76787 numMergedOcc 0
