0 mol 16 unq 0 iso 0 dist 9.76968 4.2139 6.31718 8.8641 6.92781 5.05803 9.68387 10.4366 6.93532 5.30082 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 6.11056 10.4744 8.86116 14.4535 10.0952 6.86014 16.6031 14.012 9.41441 6.66749 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 8.88413 5.59268 7.17969 10.5993 4.33106 7.57578 11.6272 10.8498 6.16347 9.34396 numMergedOcc 0
3 mol 25 unq 1 iso 0 dist 8.88413 5.59268 7.17969 10.5993 4.33106 7.57578 7.05148 5.30154 7.92503 6.11127 numMergedOcc 0
4 mol 25 unq 2 iso 0 dist 9.87281 6.17631 7.31767 7.63928 4.51512 6.03987 7.05148 5.64303 8.6653 5.82503 numMergedOcc 0
5 mol 25 unq 3 iso 0 dist 7.63928 6.17631 6.03987 9.87281 4.51512 7.31767 7.05148 5.82503 8.6653 5.64303 numMergedOcc 0
6 mol 58 unq 0 iso 0 dist 6.36193 5.40367 6.62496 9.01612 5.30792 6.86465 5.84625 9.95364 8.80614 10.2049 numMergedOcc 0
7 mol 58 unq 1 iso 0 dist 6.36193 5.40367 6.62496 4.88613 4.81926 6.35756 5.84625 9.95364 8.80614 5.49591 numMergedOcc 0
8 mol 58 unq 2 iso 0 dist 4.88613 5.40367 6.35756 9.01612 5.35073 6.86465 5.84625 5.49591 8.80614 10.2049 numMergedOcc 0
9 mol 58 unq 3 iso 0 dist 4.88613 5.40367 6.35756 6.36193 4.81926 6.62496 5.84625 5.49591 8.80614 9.95364 numMergedOcc 0
10 mol 59 unq 0 iso 0 dist 6.65344 13.1729 7.71095 19.1673 12.5396 8.84665 16.2055 9.64444 6.73347 4.36133 numMergedOcc 0
11 mol 59 unq 1 iso 0 dist 6.65344 13.1729 7.71095 14.3301 8.19458 8.25513 16.2055 9.64444 6.73347 6.66692 numMergedOcc 0
12 mol 59 unq 2 iso 0 dist 7.7978 6.8958 7.17396 10.3954 6.05545 9.21998 12.9886 6.90592 8.08618 7.6021 numMergedOcc 0
13 mol 59 unq 3 iso 0 dist 9.55751 5.85228 7.17396 10.7234 6.05545 9.21998 13.0785 6.90592 8.08618 7.6021 numMergedOcc 0
14 mol 73 unq 0 iso 0 dist 6.18305 4.69583 6.19304 11.0671 5.4148 9.96396 9.54477 6.56633 9.24757 5.11416 numMergedOcc 0
15 mol 73 unq 1 iso 0 dist 6.18305 4.69583 6.19304 13.2599 13.3558 8.70481 9.54477 6.56633 9.24757 15.3808 numMergedOcc 0
16 mol 95 unq 0 iso 0 dist 9.65047 5.69671 8.03644 12.5791 16.6055 9.03572 9.49995 11.4333 9.49454 13.3662 numMergedOcc 0
17 mol 95 unq 1 iso 0 dist 9.65047 5.69671 8.03644 13.9545 13.8105 8.83255 9.49995 11.4333 9.49454 12.0666 numMergedOcc 0
18 mol 131 unq 0 iso 0 dist 7.81337 11.4498 6.85062 15.7871 10.7062 8.40312 15.1282 13.7237 9.90168 7.7567 numMergedOcc 0
19 mol 131 unq 1 iso 0 dist 7.81337 11.4498 6.85062 10.4432 6.63273 7.12972 15.1282 13.7237 9.90168 8.23791 numMergedOcc 0
20 mol 134 unq 0 iso 0 dist 9.92932 10.5108 8.94367 9.60411 5.49782 6.37586 12.1527 4.57832 6.23142 5.29786 numMergedOcc 0
21 mol 134 unq 1 iso 0 dist 9.92932 10.5108 8.94367 14.0674 8.80819 6.49416 12.1527 4.57832 6.23142 5.71679 numMergedOcc 0
22 mol 134 unq 2 iso 0 dist 9.92932 6.20443 9.86662 9.60411 5.49782 9.71307 12.1527 4.57832 9.94764 5.29786 numMergedOcc 0
23 mol 134 unq 3 iso 0 dist 9.60411 10.5108 6.37586 9.92932 5.49782 8.94367 12.1527 5.29786 6.23142 4.57832 numMergedOcc 0
24 mol 134 unq 4 iso 0 dist 9.60411 10.5108 6.37586 14.0674 5.00817 6.49416 12.1527 5.29786 6.23142 5.71679 numMergedOcc 0
25 mol 134 unq 5 iso 0 dist 9.60411 6.20443 9.71307 9.92932 5.49782 9.86662 12.1527 5.29786 9.94764 4.57832 numMergedOcc 0
26 mol 134 unq 6 iso 0 dist 9.55556 11.9294 8.94367 12.1043 5.49782 6.37586 11.9876 4.57832 6.23142 5.29786 numMergedOcc 0
27 mol 134 unq 7 iso 0 dist 9.55556 11.9294 8.94367 16.0579 8.80819 6.49416 11.9876 4.57832 6.23142 5.71679 numMergedOcc 0
28 mol 134 unq 8 iso 0 dist 9.55556 6.36794 9.86662 12.1043 5.49782 9.71307 11.9876 4.57832 9.94764 5.29786 numMergedOcc 0
29 mol 205 unq 0 iso 0 dist 6.752 4.2475 7.45763 13.2057 11.8283 9.61492 7.23557 5.8535 4.8668 9.13652 numMergedOcc 0
30 mol 205 unq 1 iso 0 dist 5.4913 6.8901 7.45763 13.3164 11.8283 9.61492 8.86587 5.8535 4.8668 9.13652 numMergedOcc 0
31 mol 222 unq 0 iso 0 dist 7.85877 4.82768 7.21333 10.8522 13.3522 8.01589 5.89818 7.75656 7.67576 10.3151 numMergedOcc 0
32 mol 222 unq 1 iso 0 dist 7.85877 4.82768 7.21333 10.8522 13.3522 8.01589 9.32543 16.0949 9.82371 8.52017 numMergedOcc 0
33 mol 222 unq 2 iso 0 dist 7.85877 4.82768 7.21333 10.0664 5.24516 7.7699 5.89818 7.75656 7.67576 7.81022 numMergedOcc 0
34 mol 222 unq 3 iso 0 dist 7.85877 4.82768 7.21333 10.0664 5.24516 7.7699 9.32543 16.0949 9.82371 15.7504 numMergedOcc 0
35 mol 231 unq 0 iso 0 dist 8.01942 8.55683 8.40182 9.97221 4.06055 7.37839 15.781 12.1512 7.79066 9.0443 numMergedOcc 0
36 mol 259 unq 0 iso 0 dist 5.90645 10.4985 8.13497 9.73107 4.69778 7.88519 13.1095 8.41846 7.98231 8.81835 numMergedOcc 0
37 mol 264 unq 0 iso 0 dist 8.19504 3.93713 6.24356 13.1873 10.3202 9.361 9.3201 5.00209 7.16853 11.1431 numMergedOcc 0
38 mol 274 unq 0 iso 0 dist 9.71801 5.9882 7.56915 13.4994 6.33073 8.49997 9.02071 6.20558 9.85289 11.4459 numMergedOcc 0
