0 mol 7 unq 0 iso 0 dist 7.15434 11.2706 7.10621 7.29541 5.72491 5.44992 11.9621 12.2041 12.2333 7.88043 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 4.92734 7.35767 8.96553 9.91124 7.3915 7.43529 13.8619 12.4076 10.9634 6.82379 numMergedOcc 0
2 mol 8 unq 1 iso 0 dist 4.92734 7.35767 8.96553 9.91124 7.3915 7.43529 12.8381 9.22548 12.9396 6.24978 numMergedOcc 0
3 mol 8 unq 2 iso 0 dist 4.92734 7.35767 8.96553 9.91124 7.3915 7.43529 11.723 7.96511 14.7769 9.66439 numMergedOcc 0
4 mol 25 unq 0 iso 0 dist 6.23095 10.747 7.31767 6.06832 5.81959 7.63409 11.9439 10.6808 12.4135 6.90155 numMergedOcc 0
5 mol 25 unq 1 iso 0 dist 6.23095 11.5983 6.03987 6.06832 5.81959 8.4666 11.9439 10.6808 11.6743 6.90155 numMergedOcc 0
6 mol 26 unq 0 iso 0 dist 7.51406 6.4487 8.34347 6.81213 5.69955 10.6756 14.9006 9.78225 17.7357 8.6385 numMergedOcc 0
7 mol 43 unq 0 iso 0 dist 9.17086 5.90113 8.80331 8.33667 9.93832 9.06158 10.615 8.13395 6.20293 8.60739 numMergedOcc 0
8 mol 70 unq 0 iso 0 dist 7.63663 14.2824 9.65964 6.69775 6.54023 9.03317 12.2091 5.22626 10.1773 9.31969 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 8.124 13.4367 6.19304 16.0036 8.73253 8.26458 10.1112 5.4148 9.96396 7.04044 numMergedOcc 0
10 mol 73 unq 1 iso 0 dist 8.16299 10.3774 8.70481 11.9686 8.85586 14.8866 10.8051 8.07446 16.0098 5.16364 numMergedOcc 0
11 mol 73 unq 2 iso 0 dist 8.27015 12.6626 8.70481 16.4476 8.85586 14.8866 13.7608 8.07446 16.0098 5.16364 numMergedOcc 0
12 mol 109 unq 0 iso 0 dist 8.84523 14.7654 8.69985 9.01694 5.34214 9.14441 9.45397 4.98336 13.4572 7.55384 numMergedOcc 0
13 mol 119 unq 0 iso 0 dist 8.62648 4.6251 8.73993 8.9683 8.56342 4.91132 11.5266 4.85907 10.3704 7.99857 numMergedOcc 0
14 mol 131 unq 0 iso 0 dist 9.33945 12.3624 8.40312 11.8905 8.86329 5.89022 14.2573 5.55373 7.12972 8.71039 numMergedOcc 0
15 mol 131 unq 1 iso 0 dist 8.99949 11.3502 6.85062 14.8405 9.29384 9.32969 21.5913 13.2572 14.2958 9.15431 numMergedOcc 0
16 mol 131 unq 2 iso 0 dist 8.99949 11.3502 6.85062 14.8405 9.29384 9.32969 15.0798 6.63273 7.12972 6.92648 numMergedOcc 0
17 mol 205 unq 0 iso 0 dist 6.15806 10.6362 7.26832 6.37333 5.60393 5.28092 12.9169 7.38516 6.03031 8.44861 numMergedOcc 0
18 mol 222 unq 0 iso 0 dist 8.7419 5.01062 6.00706 7.26742 7.862 6.42798 15.7704 10.5806 12.6531 9.2581 numMergedOcc 0
19 mol 222 unq 1 iso 0 dist 8.7419 5.01062 6.00706 7.26742 7.862 6.42798 12.9952 6.9154 11.8674 9.62632 numMergedOcc 0
20 mol 227 unq 0 iso 0 dist 9.60159 7.51316 7.22101 11.2986 8.38865 11.0628 12.0857 5.22356 8.65997 5.4694 numMergedOcc 0
21 mol 227 unq 1 iso 0 dist 9.60159 6.38287 7.09863 11.2986 8.38865 12.9587 12.0857 5.22356 10.8157 5.4694 numMergedOcc 0
22 mol 258 unq 0 iso 0 dist 8.21585 5.13233 6.42289 12.2193 7.99477 7.42673 10.7821 7.26417 6.60405 6.70815 numMergedOcc 0
23 mol 258 unq 1 iso 0 dist 8.21585 5.13233 6.42289 8.45446 7.86627 6.44209 10.6274 5.30627 10.1675 7.93574 numMergedOcc 0
24 mol 264 unq 0 iso 0 dist 6.8902 12.3593 9.17653 5.86656 6.14323 13.0621 9.5903 4.92077 13.4025 6.04162 numMergedOcc 0
