0 mol 7 unq 0 iso 0 dist 9.67498 15.0231 9.85726 17.8527 10.4879 7.32392 19.619 14.3476 4.77411 8.40995 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.32945 17.302 9.85726 15.7555 10.4879 7.32392 20.8876 14.3476 4.77411 8.40995 numMergedOcc 0
2 mol 14 unq 0 iso 0 dist 7.66311 4.15151 8.39221 8.88058 6.09608 6.89209 10.4417 11.2773 9.85095 8.05352 numMergedOcc 0
3 mol 14 unq 1 iso 0 dist 7.66311 4.15151 8.39221 8.88058 6.09608 6.89209 6.98961 10.7348 6.83016 8.5032 numMergedOcc 0
4 mol 61 unq 0 iso 0 dist 8.30431 6.32949 9.62468 10.2903 14.0458 9.70415 16.3225 21.5858 16.1373 7.77128 numMergedOcc 0
5 mol 61 unq 1 iso 0 dist 4.628 6.32949 5.92705 10.2903 6.47853 9.70415 16.3225 13.6568 16.1373 7.77128 numMergedOcc 0
6 mol 98 unq 0 iso 0 dist 9.35633 16.255 9.59261 10.4739 6.14241 5.85841 17.3887 9.80586 4.04716 7.88143 numMergedOcc 0
7 mol 98 unq 1 iso 0 dist 9.35633 16.255 9.59261 10.4739 6.14241 5.85841 16.4411 12.3071 4.75433 6.62952 numMergedOcc 0
8 mol 98 unq 2 iso 0 dist 9.35633 16.255 9.59261 13.6924 10.8152 6.78839 16.4411 12.3071 4.75433 4.3521 numMergedOcc 0
9 mol 98 unq 3 iso 0 dist 9.35633 9.75148 6.67936 10.4739 6.14241 7.00285 17.3887 9.80586 13.0429 7.88143 numMergedOcc 0
10 mol 98 unq 4 iso 0 dist 9.35633 9.75148 6.67936 10.4739 6.14241 7.00285 16.4411 12.3071 11.5098 6.62952 numMergedOcc 0
11 mol 98 unq 5 iso 0 dist 9.35633 9.75148 6.67936 13.6924 10.8152 8.02354 16.4411 12.3071 11.5098 4.3521 numMergedOcc 0
12 mol 224 unq 0 iso 0 dist 7.62593 11.4653 9.33771 18.4903 13.9782 9.73411 22.1725 17.2837 11.2298 8.18749 numMergedOcc 0
13 mol 238 unq 0 iso 0 dist 5.57184 7.01206 5.24313 10.5902 12.2489 7.64276 7.18715 11.9776 10.313 7.75366 numMergedOcc 0
14 mol 249 unq 0 iso 0 dist 6.18866 6.28944 5.78121 9.39819 7.82195 7.72708 12.5156 12.319 9.37444 5.70674 numMergedOcc 0
15 mol 258 unq 0 iso 0 dist 8.97411 4.6881 5.73296 5.04068 9.93782 8.40766 8.45406 15.1306 11.3925 9.53832 numMergedOcc 0
16 mol 274 unq 0 iso 0 dist 9.07452 6.11218 7.80446 6.08059 5.44831 8.30175 9.62798 7.32898 4.54436 9.11322 numMergedOcc 0
17 mol 274 unq 1 iso 0 dist 7.21004 6.11218 9.91395 6.08059 9.91966 8.30175 9.62798 13.5872 4.54436 9.11322 numMergedOcc 0
18 mol 274 unq 2 iso 0 dist 6.44266 6.98398 7.80446 10.2998 5.44831 8.30175 8.2168 7.32898 4.54436 9.11322 numMergedOcc 0
19 mol 274 unq 3 iso 0 dist 8.75703 6.98398 9.91395 10.2998 9.91966 8.30175 8.2168 13.5872 4.54436 9.11322 numMergedOcc 0
20 mol 277 unq 0 iso 0 dist 8.81903 5.28949 6.60309 13.1115 5.76075 8.82899 13.4534 10.6513 8.31543 7.25282 numMergedOcc 0
