0 mol 1 unq 0 iso 0 dist 6.04659 9.40282 9.02078 4.61559 8.40848 6.4181 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.44899 8.54885 4.87741 5.08675 5.29367 6.89136 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 9.79074 8.54885 16.1501 5.08675 14.3338 6.89136 numMergedOcc 0
3 mol 30 unq 0 iso 0 dist 8.87499 3.68549 7.19972 6.21952 8.61226 6.88974 numMergedOcc 0
4 mol 30 unq 1 iso 0 dist 8.87499 3.68549 7.19972 5.06613 12.3376 5.5814 numMergedOcc 0
5 mol 30 unq 2 iso 0 dist 8.2359 3.68549 6.67111 6.21952 5.90481 6.88974 numMergedOcc 0
6 mol 30 unq 3 iso 0 dist 8.2359 3.68549 6.67111 5.06613 6.30807 5.5814 numMergedOcc 0
7 mol 33 unq 0 iso 0 dist 9.90906 8.87925 6.08005 12.3928 11.1496 7.14232 numMergedOcc 0
8 mol 69 unq 0 iso 0 dist 8.29997 8.27307 5.08122 5.10938 7.17678 5.47319 numMergedOcc 0
9 mol 69 unq 1 iso 0 dist 8.29997 6.92837 9.69519 5.10938 7.17678 9.8809 numMergedOcc 0
10 mol 90 unq 0 iso 0 dist 5.89962 7.96299 4.53359 4.5896 4.90079 7.75811 numMergedOcc 0
11 mol 110 unq 0 iso 0 dist 7.34054 7.77678 4.60073 4.9839 11.289 9.73174 numMergedOcc 0
12 mol 110 unq 1 iso 0 dist 7.34054 7.77678 4.60073 4.36119 9.95088 9.65418 numMergedOcc 0
13 mol 110 unq 2 iso 0 dist 7.36326 7.77678 5.33778 4.9839 8.36172 9.73174 numMergedOcc 0
14 mol 110 unq 3 iso 0 dist 7.36326 7.77678 5.33778 4.36119 10.3804 9.65418 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 7.98255 8.95433 10.3096 15.4773 19.5759 9.50322 numMergedOcc 0
16 mol 154 unq 0 iso 0 dist 8.36066 6.44195 6.95651 5.32921 12.9356 9.93555 numMergedOcc 0
17 mol 154 unq 1 iso 0 dist 8.36066 7.34207 4.41003 9.95968 10.3455 6.23399 numMergedOcc 0
18 mol 167 unq 0 iso 0 dist 9.33818 6.53913 9.37794 4.88159 12.1474 5.59806 numMergedOcc 0
19 mol 186 unq 0 iso 0 dist 8.30192 9.52413 11.3614 16.5529 15.6713 8.03995 numMergedOcc 0
20 mol 186 unq 1 iso 0 dist 7.59599 6.0639 9.21913 4.40927 10.477 7.80299 numMergedOcc 0
21 mol 186 unq 2 iso 0 dist 7.76429 6.0639 11.1768 4.40927 9.71888 7.80299 numMergedOcc 0
22 mol 186 unq 3 iso 0 dist 7.73733 6.0639 7.03438 4.40927 8.6011 7.80299 numMergedOcc 0
23 mol 218 unq 0 iso 0 dist 6.25383 9.79816 5.09263 16.0359 11.8619 7.73315 numMergedOcc 0
24 mol 238 unq 0 iso 0 dist 7.41211 9.39537 15.529 6.43015 12.3045 6.24928 numMergedOcc 0
25 mol 241 unq 0 iso 0 dist 4.80928 6.90245 10.2076 3.92006 7.79013 9.10633 numMergedOcc 0
26 mol 241 unq 1 iso 0 dist 9.92576 6.90245 10.1832 3.92006 9.33399 9.10633 numMergedOcc 0
27 mol 265 unq 0 iso 0 dist 5.67503 8.49415 4.75685 8.73438 8.09021 9.772 numMergedOcc 0
28 mol 265 unq 1 iso 0 dist 8.35562 8.49415 11.5105 8.73438 6.98451 9.772 numMergedOcc 0
29 mol 277 unq 0 iso 0 dist 9.581 8.33977 4.627 14.7999 12.4515 9.77689 numMergedOcc 0
30 mol 277 unq 1 iso 0 dist 9.581 8.33977 4.627 5.65499 11.9559 8.51931 numMergedOcc 0
31 mol 277 unq 2 iso 0 dist 9.581 8.66941 8.52993 5.65499 11.9559 8.96343 numMergedOcc 0
32 mol 277 unq 3 iso 0 dist 6.87362 8.33977 5.07427 14.7999 10.5015 9.77689 numMergedOcc 0
33 mol 277 unq 4 iso 0 dist 6.87362 8.33977 5.07427 5.65499 9.84936 8.51931 numMergedOcc 0
34 mol 277 unq 5 iso 0 dist 6.87362 8.66941 10.2752 5.65499 9.84936 8.96343 numMergedOcc 0
