0 mol 69 unq 0 iso 0 dist 7.70037 9.37881 9.06379 13.7644 8.36667 8.09373 numMergedOcc 0
1 mol 69 unq 1 iso 0 dist 7.96207 10.7397 9.06379 4.70213 8.36667 8.09373 numMergedOcc 0
2 mol 69 unq 2 iso 0 dist 6.57452 6.00694 4.49869 11.6815 9.22636 5.87879 numMergedOcc 0
3 mol 114 unq 0 iso 0 dist 6.15949 9.74115 9.26301 5.67441 5.31281 12.5962 numMergedOcc 0
4 mol 114 unq 1 iso 0 dist 6.15949 9.74115 9.26301 10.0602 8.9922 17.733 numMergedOcc 0
5 mol 130 unq 0 iso 0 dist 7.03253 9.31277 9.9205 6.37593 8.50054 5.23471 numMergedOcc 0
6 mol 130 unq 1 iso 0 dist 7.03253 9.31277 9.9205 6.87055 7.47653 10.647 numMergedOcc 0
7 mol 130 unq 2 iso 0 dist 7.03253 9.31277 9.9205 6.09126 8.97124 13.6393 numMergedOcc 0
8 mol 141 unq 0 iso 0 dist 8.3097 5.41269 8.04823 11.948 8.56593 10.9571 numMergedOcc 0
9 mol 148 unq 0 iso 0 dist 6.4413 4.16381 6.17633 13.2694 9.71692 9.59882 numMergedOcc 0
10 mol 148 unq 1 iso 0 dist 6.4413 7.58385 9.32264 13.2694 9.71692 9.435 numMergedOcc 0
11 mol 150 unq 0 iso 0 dist 6.62609 4.19097 6.20295 13.3379 9.73708 9.57563 numMergedOcc 0
12 mol 150 unq 1 iso 0 dist 6.62609 7.5757 9.34249 13.3379 9.73708 9.39127 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 5.99801 8.41913 8.86673 11.7811 9.45817 13.6535 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 5.60195 14.0724 9.64006 8.66923 7.86207 16.6231 numMergedOcc 0
15 mol 220 unq 1 iso 0 dist 7.87359 17.2878 9.64006 5.3178 7.86207 16.6231 numMergedOcc 0
16 mol 241 unq 0 iso 0 dist 7.16232 5.6317 9.82576 10.121 9.174 10.1581 numMergedOcc 0
17 mol 245 unq 0 iso 0 dist 8.03294 4.69333 5.70624 6.5213 7.26913 4.84566 numMergedOcc 0
18 mol 245 unq 1 iso 0 dist 8.03294 4.69333 5.70624 13.9182 6.41862 11.4898 numMergedOcc 0
19 mol 245 unq 2 iso 0 dist 8.03294 4.69333 5.70624 13.8285 8.69377 13.484 numMergedOcc 0
20 mol 279 unq 0 iso 0 dist 6.85288 10.6958 9.72665 11.71 9.98985 4.80106 numMergedOcc 0
21 mol 279 unq 1 iso 0 dist 6.85288 10.6958 9.72665 10.2918 7.22295 5.29536 numMergedOcc 0
22 mol 285 unq 0 iso 0 dist 8.17214 13.224 7.47103 14.6688 8.63954 5.35253 numMergedOcc 0
23 mol 285 unq 1 iso 0 dist 8.17214 13.224 7.47103 8.64319 4.74716 4.91258 numMergedOcc 0
