0 mol 7 unq 0 iso 0 dist 8.75465 8.00249 4.80709 15.0884 9.87885 14.1836 13.0935 12.8323 16.5681 8.41585 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.75465 8.00249 4.80709 6.3236 6.1206 7.67927 12.8676 7.12508 11.143 7.10621 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 8.00249 8.75465 4.80709 6.3236 7.67927 6.1206 12.8676 11.143 7.12508 7.10621 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 8.48944 9.04448 11.9756 14.0586 7.27472 17.003 10.6551 5.50396 10.1698 7.36323 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 8.48944 6.6834 13.4516 14.0586 7.27472 16.707 10.6551 5.50396 13.6174 7.36323 numMergedOcc 0
5 mol 24 unq 2 iso 0 dist 9.04448 8.48944 11.9756 9.67461 5.68215 9.33482 10.6551 10.1698 5.50396 5.54419 numMergedOcc 0
6 mol 24 unq 3 iso 0 dist 9.04448 6.6834 10.7501 9.67461 5.68215 10.9113 10.6551 10.1698 13.6174 5.54419 numMergedOcc 0
7 mol 24 unq 4 iso 0 dist 6.6834 8.48944 13.4516 13.4994 7.95042 17.9275 9.88461 5.69214 16.5942 6.86014 numMergedOcc 0
8 mol 24 unq 5 iso 0 dist 6.6834 8.48944 13.4516 13.4994 7.95042 17.9275 9.79529 5.11636 14.4081 8.86116 numMergedOcc 0
9 mol 24 unq 6 iso 0 dist 6.6834 9.04448 10.7501 13.4994 7.95042 12.5088 9.88461 5.69214 8.91183 6.86014 numMergedOcc 0
10 mol 24 unq 7 iso 0 dist 6.6834 9.04448 10.7501 13.4994 7.95042 12.5088 9.79529 5.11636 14.8647 8.86116 numMergedOcc 0
11 mol 95 unq 0 iso 0 dist 8.57607 7.84956 10.3056 4.16047 8.27883 11.5783 7.90775 4.99174 7.45908 9.03572 numMergedOcc 0
12 mol 95 unq 1 iso 0 dist 8.57607 7.84956 10.3056 4.16047 8.27883 11.5783 9.96562 8.67311 12.8581 8.83255 numMergedOcc 0
13 mol 95 unq 2 iso 0 dist 8.57607 7.84956 10.3056 4.16047 8.27883 11.5783 11.3191 15.6249 19.0988 8.03644 numMergedOcc 0
14 mol 95 unq 3 iso 0 dist 8.57607 6.1991 6.27231 4.16047 8.27883 5.75428 7.90775 4.99174 4.46005 9.03572 numMergedOcc 0
15 mol 95 unq 4 iso 0 dist 8.57607 6.1991 6.27231 4.16047 8.27883 5.75428 9.96562 8.67311 3.94293 8.83255 numMergedOcc 0
16 mol 95 unq 5 iso 0 dist 8.57607 6.1991 6.27231 4.16047 8.27883 5.75428 11.3191 15.6249 12.4896 8.03644 numMergedOcc 0
17 mol 95 unq 6 iso 0 dist 8.57607 5.96246 11.734 4.16047 8.27883 8.57395 7.90775 4.99174 8.28518 9.03572 numMergedOcc 0
18 mol 95 unq 7 iso 0 dist 8.57607 5.96246 11.734 4.16047 8.27883 8.57395 9.96562 8.67311 9.22202 8.83255 numMergedOcc 0
19 mol 95 unq 8 iso 0 dist 8.57607 5.96246 11.734 4.16047 8.27883 8.57395 11.3191 15.6249 14.2178 8.03644 numMergedOcc 0
20 mol 95 unq 9 iso 0 dist 6.1991 7.84956 9.77913 4.16047 5.75428 11.5783 7.90775 4.46005 7.45908 9.03572 numMergedOcc 0
21 mol 95 unq 10 iso 0 dist 6.1991 7.84956 9.77913 4.16047 5.75428 11.5783 9.96562 3.94293 12.8581 8.83255 numMergedOcc 0
22 mol 95 unq 11 iso 0 dist 6.1991 7.84956 9.77913 4.16047 5.75428 11.5783 11.3191 12.4896 19.0988 8.03644 numMergedOcc 0
23 mol 95 unq 12 iso 0 dist 6.1991 8.57607 6.27231 4.16047 5.75428 8.27883 7.90775 4.46005 4.99174 9.03572 numMergedOcc 0
24 mol 95 unq 13 iso 0 dist 6.1991 8.57607 6.27231 4.16047 5.75428 8.27883 9.96562 3.94293 8.67311 8.83255 numMergedOcc 0
25 mol 95 unq 14 iso 0 dist 6.1991 8.57607 6.27231 4.16047 5.75428 8.27883 11.3191 12.4896 15.6249 8.03644 numMergedOcc 0
26 mol 95 unq 15 iso 0 dist 6.1991 5.96246 6.95874 4.16047 5.75428 8.57395 7.90775 4.46005 8.28518 9.03572 numMergedOcc 0
27 mol 95 unq 16 iso 0 dist 6.1991 5.96246 6.95874 4.16047 5.75428 8.57395 9.96562 3.94293 9.22202 8.83255 numMergedOcc 0
28 mol 95 unq 17 iso 0 dist 6.1991 5.96246 6.95874 4.16047 5.75428 8.57395 11.3191 12.4896 14.2178 8.03644 numMergedOcc 0
29 mol 95 unq 18 iso 0 dist 5.96246 7.84956 7.51315 4.16047 8.57395 11.5783 7.90775 8.28518 7.45908 9.03572 numMergedOcc 0
30 mol 95 unq 19 iso 0 dist 5.96246 7.84956 7.51315 4.16047 8.57395 11.5783 9.96562 9.22202 12.8581 8.83255 numMergedOcc 0
31 mol 95 unq 20 iso 0 dist 5.96246 7.84956 7.51315 4.16047 8.57395 11.5783 11.3191 14.2178 19.0988 8.03644 numMergedOcc 0
32 mol 95 unq 21 iso 0 dist 5.96246 8.57607 11.734 4.16047 8.57395 8.27883 7.90775 8.28518 4.99174 9.03572 numMergedOcc 0
33 mol 95 unq 22 iso 0 dist 5.96246 8.57607 11.734 4.16047 8.57395 8.27883 9.96562 9.22202 8.67311 8.83255 numMergedOcc 0
34 mol 95 unq 23 iso 0 dist 5.96246 8.57607 11.734 4.16047 8.57395 8.27883 11.3191 14.2178 15.6249 8.03644 numMergedOcc 0
35 mol 95 unq 24 iso 0 dist 5.96246 6.1991 6.95874 4.16047 8.57395 5.75428 7.90775 8.28518 4.46005 9.03572 numMergedOcc 0
36 mol 95 unq 25 iso 0 dist 5.96246 6.1991 6.95874 4.16047 8.57395 5.75428 9.96562 9.22202 3.94293 8.83255 numMergedOcc 0
37 mol 95 unq 26 iso 0 dist 5.96246 6.1991 6.95874 4.16047 8.57395 5.75428 11.3191 14.2178 12.4896 8.03644 numMergedOcc 0
38 mol 98 unq 0 iso 0 dist 5.91797 6.37954 6.70343 9.41666 7.54889 5.2571 9.32725 10.4782 3.9764 6.10456 numMergedOcc 0
39 mol 98 unq 1 iso 0 dist 6.37954 5.91797 6.70343 5.90686 5.10496 9.81956 9.32725 3.9764 10.4782 5.08437 numMergedOcc 0
40 mol 98 unq 2 iso 0 dist 6.37954 5.91797 6.70343 11.2946 5.92242 10.8223 9.32725 3.9764 10.4782 6.48948 numMergedOcc 0
41 mol 98 unq 3 iso 0 dist 6.37954 5.91797 6.70343 9.41666 5.2571 7.54889 9.32725 3.9764 10.4782 6.10456 numMergedOcc 0
42 mol 134 unq 0 iso 0 dist 7.76446 6.14652 5.83782 10.4858 9.1998 8.69531 9.79337 12.8086 7.41373 9.86662 numMergedOcc 0
43 mol 134 unq 1 iso 0 dist 7.76446 6.14652 5.83782 10.4858 9.1998 8.69531 10.5814 15.0225 10.8635 9.71307 numMergedOcc 0
44 mol 134 unq 2 iso 0 dist 6.14652 7.76446 5.83782 7.07625 9.33094 11.0808 9.79337 7.41373 12.8086 8.94367 numMergedOcc 0
45 mol 134 unq 3 iso 0 dist 6.14652 7.76446 5.83782 7.07625 9.33094 11.0808 10.5814 10.8635 15.0225 6.37586 numMergedOcc 0
46 mol 134 unq 4 iso 0 dist 6.14652 7.76446 5.83782 7.07625 9.33094 11.0808 9.42271 12.3479 15.9138 6.49416 numMergedOcc 0
47 mol 134 unq 5 iso 0 dist 6.14652 7.76446 5.83782 10.4858 8.69531 9.1998 9.79337 7.41373 12.8086 9.86662 numMergedOcc 0
48 mol 134 unq 6 iso 0 dist 6.14652 7.76446 5.83782 10.4858 8.69531 9.1998 10.5814 10.8635 15.0225 9.71307 numMergedOcc 0
49 mol 152 unq 0 iso 0 dist 9.4275 9.83462 3.55572 5.65129 6.59889 8.9192 8.34839 5.39112 4.84714 8.56324 numMergedOcc 0
50 mol 152 unq 1 iso 0 dist 9.4275 9.83462 3.55572 10.5295 6.70693 9.27706 12.6531 4.94983 5.97582 5.87555 numMergedOcc 0
51 mol 152 unq 2 iso 0 dist 9.4275 9.83462 3.55572 10.5295 6.70693 9.27706 8.34839 5.39112 4.84714 6.70283 numMergedOcc 0
52 mol 152 unq 3 iso 0 dist 9.4275 9.83462 3.55572 10.5295 6.70693 9.27706 14.5994 9.67475 9.20746 8.67331 numMergedOcc 0
53 mol 152 unq 4 iso 0 dist 9.83462 9.4275 3.55572 5.65129 8.9192 6.59889 8.34839 4.84714 5.39112 8.56324 numMergedOcc 0
54 mol 186 unq 0 iso 0 dist 9.00537 6.04336 7.15345 9.40374 6.61112 10.8806 10.8152 11.0961 11.3979 7.54065 numMergedOcc 0
55 mol 205 unq 0 iso 0 dist 6.32553 9.71147 8.01847 9.40714 6.52816 13.5527 13.7769 9.49403 14.0801 6.03031 numMergedOcc 0
56 mol 205 unq 1 iso 0 dist 6.32553 9.71147 8.01847 9.40714 6.52816 13.5527 16.4532 13.514 20.136 7.26832 numMergedOcc 0
57 mol 205 unq 2 iso 0 dist 6.32553 9.71147 8.01847 9.40714 6.52816 13.5527 9.25882 3.56269 6.95738 7.80463 numMergedOcc 0
58 mol 222 unq 0 iso 0 dist 8.63804 8.61619 3.58181 4.81906 5.56538 7.48954 11.4413 6.84862 9.53117 7.21333 numMergedOcc 0
59 mol 222 unq 1 iso 0 dist 8.61619 8.63804 3.58181 4.81906 7.48954 5.56538 11.4413 9.53117 6.84862 7.21333 numMergedOcc 0
60 mol 229 unq 0 iso 0 dist 9.90415 6.92268 9.01727 6.52416 7.27993 10.3243 6.32302 5.70473 4.17276 8.22528 numMergedOcc 0
61 mol 229 unq 1 iso 0 dist 9.90415 6.92268 9.01727 6.52416 7.27993 10.3243 6.88694 7.22525 4.92403 7.03423 numMergedOcc 0
62 mol 229 unq 2 iso 0 dist 9.90415 6.92268 9.01727 12.9522 6.95201 14.8281 13.808 4.61227 10.7313 9.87838 numMergedOcc 0
63 mol 243 unq 0 iso 0 dist 8.96099 9.30388 6.27924 5.13362 7.10671 10.5519 11.9467 5.74165 10.2068 8.23192 numMergedOcc 0
64 mol 243 unq 1 iso 0 dist 6.56525 5.78671 6.68192 5.8297 7.10671 10.5333 10.8689 5.74165 11.6019 8.23192 numMergedOcc 0
65 mol 243 unq 2 iso 0 dist 6.56525 5.46817 6.67199 5.8297 7.10671 8.67156 10.8689 5.74165 9.89868 8.23192 numMergedOcc 0
66 mol 243 unq 3 iso 0 dist 5.46817 5.78671 4.09189 5.8297 8.67156 10.5333 10.8689 9.89868 11.6019 8.23192 numMergedOcc 0
67 mol 243 unq 4 iso 0 dist 5.46817 6.56525 6.67199 5.8297 8.67156 7.10671 10.8689 9.89868 5.74165 8.23192 numMergedOcc 0
68 mol 277 unq 0 iso 0 dist 7.88009 5.80061 3.39114 9.57081 8.9682 6.92711 16.2514 17.6038 14.772 9.7748 numMergedOcc 0
69 mol 277 unq 1 iso 0 dist 5.80061 7.88009 3.39114 9.57081 6.92711 8.9682 16.2514 14.772 17.6038 9.7748 numMergedOcc 0
