0 mol 8 unq 0 iso 0 dist 6.82379 7.03958 5.65816 6.56356 8.64248 4.1204 4.94497 8.77457 11.3039 11.4997 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 7.05346 7.32257 8.88528 8.30653 4.3947 10.6575 8.50424 8.076 7.35972 12.1193 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 6.60423 9.41441 11.9395 7.95042 4.47891 10.0453 4.32034 9.69752 8.00171 10.8435 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 6.60423 9.41441 11.9395 7.95042 4.47891 10.0453 8.52463 9.36461 6.72323 5.80953 numMergedOcc 0
4 mol 24 unq 2 iso 0 dist 4.93188 8.70827 9.75636 6.6219 8.32592 4.04519 5.11617 4.90592 12.8389 11.3231 numMergedOcc 0
5 mol 24 unq 3 iso 0 dist 4.93188 8.70827 9.75636 6.6219 8.32592 4.04519 10.8238 8.16324 11.6684 13.0711 numMergedOcc 0
6 mol 24 unq 4 iso 0 dist 4.93188 8.70827 9.75636 5.68215 8.10397 13.7009 5.11617 4.90592 12.8389 6.61696 numMergedOcc 0
7 mol 24 unq 5 iso 0 dist 4.93188 8.70827 9.75636 5.68215 8.10397 13.7009 10.8238 8.16324 11.6684 15.3807 numMergedOcc 0
8 mol 24 unq 6 iso 0 dist 4.93188 6.73939 10.0715 6.6219 8.32592 12.5545 5.11617 4.90592 6.72323 11.3231 numMergedOcc 0
9 mol 24 unq 7 iso 0 dist 4.93188 6.73939 10.0715 6.6219 8.32592 12.5545 10.8238 8.16324 15.7523 13.0711 numMergedOcc 0
10 mol 24 unq 8 iso 0 dist 4.93188 6.73939 10.0715 5.68215 8.10397 4.08755 5.11617 4.90592 6.72323 6.61696 numMergedOcc 0
11 mol 24 unq 9 iso 0 dist 4.93188 6.73939 10.0715 5.68215 8.10397 4.08755 10.8238 8.16324 15.7523 15.3807 numMergedOcc 0
12 mol 24 unq 10 iso 0 dist 9.24958 9.12854 9.75636 8.87744 7.55689 9.86385 13.2229 4.90592 12.8389 12.3034 numMergedOcc 0
13 mol 24 unq 11 iso 0 dist 9.24958 9.12854 9.75636 8.87744 7.55689 9.86385 6.7828 8.16324 11.6684 12.6707 numMergedOcc 0
14 mol 24 unq 12 iso 0 dist 9.24958 9.12854 9.75636 7.27472 5.11135 10.4353 13.2229 4.90592 12.8389 9.84204 numMergedOcc 0
15 mol 24 unq 13 iso 0 dist 9.24958 9.12854 9.75636 7.27472 5.11135 10.4353 6.7828 8.16324 11.6684 9.586 numMergedOcc 0
16 mol 56 unq 0 iso 0 dist 6.77886 7.16773 8.25666 9.03564 10.5332 9.76482 10.0962 6.99108 14.7378 13.9879 numMergedOcc 0
17 mol 60 unq 0 iso 0 dist 7.55695 9.90939 4.82351 8.4312 5.71764 5.85676 5.94827 4.65127 8.97364 6.63448 numMergedOcc 0
18 mol 92 unq 0 iso 0 dist 8.65802 7.52354 5.8102 9.33861 10.2518 4.52323 13.534 8.57827 12.3938 15.5762 numMergedOcc 0
19 mol 92 unq 1 iso 0 dist 8.65802 7.52354 5.8102 9.33861 10.2518 4.52323 5.83515 7.94453 10.5663 13.9486 numMergedOcc 0
20 mol 100 unq 0 iso 0 dist 7.12017 7.38135 9.38256 7.82475 13.4027 7.55779 9.75737 9.5669 14.4785 17.2742 numMergedOcc 0
21 mol 100 unq 1 iso 0 dist 7.12017 7.38135 9.38256 5.35782 12.068 8.00947 9.75737 9.5669 14.4785 14.2997 numMergedOcc 0
22 mol 129 unq 0 iso 0 dist 8.03372 9.36851 6.84211 5.58833 7.06894 9.30433 4.55551 9.94578 9.73158 9.8591 numMergedOcc 0
23 mol 129 unq 1 iso 0 dist 8.03372 4.97175 4.53459 5.58833 7.06894 4.28744 4.55551 9.94578 7.59327 9.8591 numMergedOcc 0
24 mol 175 unq 0 iso 0 dist 7.35824 9.39352 10.3786 9.63417 5.68406 6.43397 11.8693 5.89564 16.2138 10.8314 numMergedOcc 0
25 mol 175 unq 1 iso 0 dist 7.35824 9.39352 10.3786 9.63417 5.68406 6.43397 6.77832 5.60528 13.4698 10.5288 numMergedOcc 0
26 mol 175 unq 2 iso 0 dist 9.17364 9.39352 11.9672 9.63417 9.31641 6.43397 6.77832 5.5995 13.4698 10.5288 numMergedOcc 0
27 mol 204 unq 0 iso 0 dist 6.85441 9.68728 5.42649 7.9133 9.54203 14.0756 5.86489 5.91727 10.2072 9.48625 numMergedOcc 0
28 mol 232 unq 0 iso 0 dist 7.83711 9.05071 13.8622 6.71524 8.03712 11.2243 4.9377 6.57921 9.8664 9.9183 numMergedOcc 0
