0 mol 5 unq 0 iso 0 dist 6.84403 6.46777 7.64769 12.2041 6.98653 8.87945 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 5.18743 6.46777 8.68577 12.2041 10.4477 8.87945 numMergedOcc 0
2 mol 28 unq 0 iso 0 dist 6.14086 6.82151 8.53424 13.6465 16.4255 9.2146 numMergedOcc 0
3 mol 28 unq 1 iso 0 dist 6.76158 4.3475 8.53424 9.77719 16.4255 9.2146 numMergedOcc 0
4 mol 28 unq 2 iso 0 dist 6.31487 6.82151 7.08766 13.6465 16.0765 9.2146 numMergedOcc 0
5 mol 28 unq 3 iso 0 dist 7.423 4.3475 7.08766 9.77719 16.0765 9.2146 numMergedOcc 0
6 mol 28 unq 4 iso 0 dist 7.07851 6.82151 4.82199 13.6465 13.6412 9.2146 numMergedOcc 0
7 mol 28 unq 5 iso 0 dist 5.89257 4.3475 4.82199 9.77719 13.6412 9.2146 numMergedOcc 0
8 mol 46 unq 0 iso 0 dist 8.13664 8.59614 3.77542 8.89554 6.08836 5.4713 numMergedOcc 0
9 mol 62 unq 0 iso 0 dist 6.0827 5.4275 4.46067 5.48283 3.73834 7.16844 numMergedOcc 0
10 mol 62 unq 1 iso 0 dist 5.23167 3.89181 4.46067 10.5789 5.98227 8.93807 numMergedOcc 0
11 mol 62 unq 2 iso 0 dist 7.47607 5.72955 4.46067 10.3662 5.98227 8.93807 numMergedOcc 0
12 mol 68 unq 0 iso 0 dist 6.82511 3.97203 7.7485 10.1526 7.18877 8.71074 numMergedOcc 0
13 mol 76 unq 0 iso 0 dist 8.26805 6.27527 7.66068 14.8387 9.50354 9.57759 numMergedOcc 0
14 mol 76 unq 1 iso 0 dist 5.61831 5.5308 7.66068 5.65006 3.35924 5.45099 numMergedOcc 0
15 mol 76 unq 2 iso 0 dist 5.61831 10.5881 9.5043 5.65006 3.35924 8.44765 numMergedOcc 0
16 mol 76 unq 3 iso 0 dist 5.61831 9.74852 8.34132 5.65006 3.35924 9.06643 numMergedOcc 0
17 mol 76 unq 4 iso 0 dist 9.68577 6.27527 9.5043 14.8387 12.0331 9.57759 numMergedOcc 0
18 mol 90 unq 0 iso 0 dist 7.30934 4.3421 5.24346 7.15918 5.4118 7.62463 numMergedOcc 0
19 mol 107 unq 0 iso 0 dist 4.99934 10.9097 8.88124 8.2411 5.88785 7.91251 numMergedOcc 0
20 mol 107 unq 1 iso 0 dist 4.99934 4.34186 8.19484 8.2411 5.88785 9.09262 numMergedOcc 0
21 mol 113 unq 0 iso 0 dist 9.00481 9.83939 5.31126 15.6211 9.59189 8.67025 numMergedOcc 0
22 mol 113 unq 1 iso 0 dist 9.00481 9.2752 7.16619 18.7543 13.8379 9.60127 numMergedOcc 0
23 mol 113 unq 2 iso 0 dist 9.27028 16.2029 7.02358 12.1666 3.52445 4.30875 numMergedOcc 0
24 mol 123 unq 0 iso 0 dist 7.49032 11.4019 8.03692 13.8007 10.3919 4.14492 numMergedOcc 0
25 mol 123 unq 1 iso 0 dist 7.04627 8.90549 8.03692 12.0877 10.3919 4.14492 numMergedOcc 0
26 mol 143 unq 0 iso 0 dist 5.24882 6.03327 4.3855 10.8829 5.94217 6.60366 numMergedOcc 0
27 mol 168 unq 0 iso 0 dist 8.47439 4.18108 5.28353 8.65328 10.919 7.0961 numMergedOcc 0
28 mol 168 unq 1 iso 0 dist 8.47439 4.18108 5.28353 11.2284 6.91388 8.21227 numMergedOcc 0
29 mol 168 unq 2 iso 0 dist 8.47439 4.18108 5.28353 5.69346 6.65321 6.53038 numMergedOcc 0
30 mol 169 unq 0 iso 0 dist 9.3206 9.93901 5.10589 16.199 9.60496 8.6961 numMergedOcc 0
31 mol 169 unq 1 iso 0 dist 6.18165 6.5732 5.10589 5.87263 3.18152 7.65903 numMergedOcc 0
32 mol 169 unq 2 iso 0 dist 6.18165 4.14139 4.63336 5.87263 3.18152 5.97653 numMergedOcc 0
33 mol 169 unq 3 iso 0 dist 6.18165 7.73206 6.10715 5.87263 3.18152 7.75523 numMergedOcc 0
34 mol 186 unq 0 iso 0 dist 7.82717 4.32488 4.87942 10.2573 4.79079 8.17928 numMergedOcc 0
35 mol 186 unq 1 iso 0 dist 8.19926 4.32488 7.25595 10.2573 3.60793 8.17928 numMergedOcc 0
36 mol 220 unq 0 iso 0 dist 6.18239 3.52029 7.83056 6.05978 3.52598 6.31365 numMergedOcc 0
37 mol 243 unq 0 iso 0 dist 8.35328 6.56644 4.55853 7.42359 7.66826 9.53137 numMergedOcc 0
38 mol 260 unq 0 iso 0 dist 7.22473 7.91474 8.62655 15.7202 15.6308 9.73217 numMergedOcc 0
39 mol 260 unq 1 iso 0 dist 7.22473 7.91474 8.62655 6.54521 7.35802 7.49606 numMergedOcc 0
40 mol 260 unq 2 iso 0 dist 7.22473 7.91474 8.62655 11.1285 10.4054 8.06377 numMergedOcc 0
41 mol 260 unq 3 iso 0 dist 6.02628 5.30931 7.04263 10.7533 8.22506 8.51564 numMergedOcc 0
42 mol 260 unq 4 iso 0 dist 7.13397 4.38276 8.62655 8.52702 15.6308 9.73217 numMergedOcc 0
43 mol 260 unq 5 iso 0 dist 7.13397 4.38276 8.62655 9.85302 7.35802 7.49606 numMergedOcc 0
44 mol 260 unq 6 iso 0 dist 7.13397 4.38276 8.62655 11.1504 10.4054 8.06377 numMergedOcc 0
45 mol 260 unq 7 iso 0 dist 5.33278 8.90225 6.48099 7.97307 3.68866 8.51564 numMergedOcc 0
46 mol 266 unq 0 iso 0 dist 6.9943 4.58167 6.96692 6.61768 3.68488 8.20376 numMergedOcc 0
47 mol 266 unq 1 iso 0 dist 7.36685 7.98379 7.8598 6.61768 3.14784 7.72861 numMergedOcc 0
48 mol 266 unq 2 iso 0 dist 7.36685 4.58167 8.25286 6.61768 3.14784 8.20376 numMergedOcc 0
49 mol 266 unq 3 iso 0 dist 9.20906 10.0526 7.80711 14.2324 5.95721 7.72861 numMergedOcc 0
50 mol 266 unq 4 iso 0 dist 9.20906 16.8584 9.9965 14.2324 5.95721 8.20376 numMergedOcc 0
51 mol 266 unq 5 iso 0 dist 9.03099 7.98379 7.80711 6.61768 5.95721 7.72861 numMergedOcc 0
52 mol 266 unq 6 iso 0 dist 9.03099 4.58167 9.9965 6.61768 5.95721 8.20376 numMergedOcc 0
53 mol 277 unq 0 iso 0 dist 7.34927 9.69757 7.98956 8.20902 10.5214 5.13533 numMergedOcc 0
54 mol 277 unq 1 iso 0 dist 7.54315 7.55695 7.98956 9.55813 10.5214 5.13533 numMergedOcc 0
