0 mol 54 unq 0 iso 0 dist 6.83299 6.14538 4.29856 7.41262 10.179 6.32568 numMergedOcc 0
1 mol 100 unq 0 iso 0 dist 9.60661 7.01812 5.80144 8.77492 12.7318 8.4705 numMergedOcc 0
2 mol 100 unq 1 iso 0 dist 7.17106 7.01812 8.4128 8.77492 13.3653 8.4705 numMergedOcc 0
3 mol 100 unq 2 iso 0 dist 9.35224 7.01812 10.0456 8.77492 16.7811 8.4705 numMergedOcc 0
4 mol 100 unq 3 iso 0 dist 7.47343 8.30845 12.2861 12.2171 14.2014 8.4705 numMergedOcc 0
5 mol 100 unq 4 iso 0 dist 6.65086 8.30845 5.80144 12.2171 12.7318 8.4705 numMergedOcc 0
6 mol 100 unq 5 iso 0 dist 6.56369 8.30845 10.0456 12.2171 16.7811 8.4705 numMergedOcc 0
7 mol 100 unq 6 iso 0 dist 9.30209 8.30845 6.70236 12.2171 15.0993 8.4705 numMergedOcc 0
8 mol 119 unq 0 iso 0 dist 8.73993 6.52773 7.20179 6.42493 11.8946 7.84768 numMergedOcc 0
9 mol 119 unq 1 iso 0 dist 9.87172 9.11344 10.9441 4.55137 8.20715 7.84768 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 9.89303 5.83771 7.41674 6.70411 11.5755 7.01507 numMergedOcc 0
11 mol 134 unq 1 iso 0 dist 6.54501 7.80532 7.41674 10.7371 11.5755 7.01507 numMergedOcc 0
12 mol 134 unq 2 iso 0 dist 6.49416 7.80532 9.87376 10.7371 10.9803 7.01507 numMergedOcc 0
13 mol 167 unq 0 iso 0 dist 9.87651 9.67741 13.0123 12.6156 20.1435 9.32545 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 7.54065 8.73217 11.7429 4.527 9.83935 7.81069 numMergedOcc 0
15 mol 192 unq 0 iso 0 dist 5.59424 8.77999 8.49529 10.375 8.63044 9.8155 numMergedOcc 0
16 mol 192 unq 1 iso 0 dist 7.00794 8.77999 11.7523 10.375 14.2991 9.8155 numMergedOcc 0
17 mol 197 unq 0 iso 0 dist 8.56633 6.92924 5.41996 4.91336 11.5739 8.43104 numMergedOcc 0
18 mol 197 unq 1 iso 0 dist 8.56633 7.14306 6.64537 4.91336 11.5739 9.13452 numMergedOcc 0
19 mol 210 unq 0 iso 0 dist 6.18308 7.10826 5.87279 7.09658 10.7105 9.69053 numMergedOcc 0
20 mol 222 unq 0 iso 0 dist 8.01589 9.82371 8.52017 8.6493 11.9662 5.77928 numMergedOcc 0
21 mol 222 unq 1 iso 0 dist 7.7699 9.82371 15.7504 8.6493 15.6298 5.77928 numMergedOcc 0
22 mol 222 unq 2 iso 0 dist 7.21333 9.82371 16.0949 8.6493 14.0597 5.77928 numMergedOcc 0
23 mol 231 unq 0 iso 0 dist 7.37839 6.98875 6.37275 7.21554 13.7654 9.97783 numMergedOcc 0
24 mol 231 unq 1 iso 0 dist 7.37839 7.79066 9.0443 6.58152 7.31553 8.68815 numMergedOcc 0
25 mol 231 unq 2 iso 0 dist 8.40182 6.54852 6.37275 7.59269 13.7654 9.97783 numMergedOcc 0
26 mol 231 unq 3 iso 0 dist 8.40182 7.79066 12.1512 6.58152 10.1674 8.68815 numMergedOcc 0
27 mol 232 unq 0 iso 0 dist 8.27212 9.05071 8.80479 8.36582 10.8158 6.02641 numMergedOcc 0
28 mol 249 unq 0 iso 0 dist 7.57994 5.48118 10.7772 5.40456 10.3622 6.72501 numMergedOcc 0
29 mol 249 unq 1 iso 0 dist 6.18582 5.48118 7.04666 5.40456 7.27415 6.72501 numMergedOcc 0
30 mol 274 unq 0 iso 0 dist 7.56915 8.52587 5.29529 8.93097 8.98154 9.71673 numMergedOcc 0
31 mol 292 unq 0 iso 0 dist 8.2734 7.07965 10.8848 9.6563 13.4294 8.22213 numMergedOcc 0
