0 mol 7 unq 0 iso 0 dist 8.75465 15.0884 9.87885 6.3236 6.1206 13.2247 13.0935 12.8323 8.41585 12.2333 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.75465 6.3236 6.1206 15.0884 9.87885 13.2247 12.8676 7.12508 7.10621 10.5461 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.74209 5.5249 6.6263 10.4413 6.75943 8.13395 8.06275 5.41726 8.80331 6.20293 numMergedOcc 0
3 mol 43 unq 1 iso 0 dist 8.74209 10.4413 6.75943 5.5249 6.6263 8.13395 12.0618 4.96926 5.73819 10.5523 numMergedOcc 0
4 mol 43 unq 2 iso 0 dist 8.74209 10.4413 6.75943 5.5249 6.6263 8.13395 8.06275 5.41726 6.20293 8.80331 numMergedOcc 0
5 mol 43 unq 3 iso 0 dist 8.74209 10.4413 6.75943 5.5249 6.6263 8.13395 14.4184 10.0383 8.93915 14.7803 numMergedOcc 0
6 mol 43 unq 4 iso 0 dist 9.85555 5.46715 6.6263 12.902 6.75943 8.13395 13.5835 5.41726 8.80331 6.20293 numMergedOcc 0
7 mol 43 unq 5 iso 0 dist 9.85555 12.902 6.75943 5.46715 6.6263 8.13395 14.4841 4.96926 5.73819 10.5523 numMergedOcc 0
8 mol 43 unq 6 iso 0 dist 9.85555 12.902 6.75943 5.46715 6.6263 8.13395 13.5835 5.41726 6.20293 8.80331 numMergedOcc 0
9 mol 43 unq 7 iso 0 dist 9.85555 12.902 6.75943 5.46715 6.6263 8.13395 19.4359 10.0383 8.93915 14.7803 numMergedOcc 0
10 mol 95 unq 0 iso 0 dist 8.57607 4.16047 8.27883 8.68514 7.7152 6.59884 7.90775 4.99174 9.03572 11.5113 numMergedOcc 0
11 mol 95 unq 1 iso 0 dist 8.57607 4.16047 8.27883 8.68514 7.7152 6.59884 9.96562 8.67311 8.83255 12.9844 numMergedOcc 0
12 mol 95 unq 2 iso 0 dist 8.57607 4.16047 8.27883 8.68514 7.7152 6.59884 11.3191 15.6249 8.03644 11.3446 numMergedOcc 0
13 mol 98 unq 0 iso 0 dist 5.91797 9.41666 7.54889 15.3018 9.64383 13.659 9.32725 10.4782 6.10456 17.4071 numMergedOcc 0
14 mol 98 unq 1 iso 0 dist 5.91797 9.41666 7.54889 9.57791 7.78931 5.02887 9.32725 10.4782 6.10456 10.1136 numMergedOcc 0
15 mol 98 unq 2 iso 0 dist 6.37954 5.90686 5.10496 11.2946 5.92242 9.51923 9.32725 3.9764 5.08437 6.48948 numMergedOcc 0
16 mol 98 unq 3 iso 0 dist 6.37954 5.90686 5.10496 9.41666 5.2571 8.40073 9.32725 3.9764 5.08437 6.10456 numMergedOcc 0
17 mol 98 unq 4 iso 0 dist 6.37954 5.90686 5.10496 9.57791 8.7497 10.2427 9.32725 3.9764 5.08437 10.1136 numMergedOcc 0
18 mol 98 unq 5 iso 0 dist 6.37954 11.2946 5.92242 5.90686 5.10496 9.51923 9.32725 3.9764 6.48948 5.08437 numMergedOcc 0
19 mol 98 unq 6 iso 0 dist 6.37954 11.2946 5.92242 9.41666 5.2571 9.42358 9.32725 3.9764 6.48948 6.10456 numMergedOcc 0
20 mol 98 unq 7 iso 0 dist 6.37954 11.2946 5.92242 9.57791 8.7497 13.9786 9.32725 3.9764 6.48948 10.1136 numMergedOcc 0
21 mol 98 unq 8 iso 0 dist 6.37954 9.41666 5.2571 5.90686 5.10496 8.40073 9.32725 3.9764 6.10456 5.08437 numMergedOcc 0
22 mol 98 unq 9 iso 0 dist 6.37954 9.41666 5.2571 11.2946 5.92242 9.42358 9.32725 3.9764 6.10456 6.48948 numMergedOcc 0
23 mol 98 unq 10 iso 0 dist 6.37954 9.41666 5.2571 9.57791 8.7497 5.02887 9.32725 3.9764 6.10456 10.1136 numMergedOcc 0
24 mol 109 unq 0 iso 0 dist 6.62354 5.68669 8.52024 4.91393 9.89083 7.15843 9.26438 5.00433 8.69985 13.1098 numMergedOcc 0
25 mol 109 unq 1 iso 0 dist 8.00085 6.80429 8.52024 12.0697 9.89083 7.15843 6.43255 5.00433 8.69985 13.1098 numMergedOcc 0
26 mol 134 unq 0 iso 0 dist 7.76446 10.4858 9.1998 6.47007 6.42772 11.6064 9.79337 12.8086 9.86662 15.281 numMergedOcc 0
27 mol 134 unq 1 iso 0 dist 7.76446 10.4858 9.1998 6.47007 6.42772 11.6064 10.5814 15.0225 9.71307 15.6507 numMergedOcc 0
28 mol 134 unq 2 iso 0 dist 7.76446 10.4858 9.1998 14.3375 8.70621 7.09823 9.79337 12.8086 9.86662 14.0375 numMergedOcc 0
29 mol 134 unq 3 iso 0 dist 7.76446 10.4858 9.1998 14.3375 8.70621 7.09823 10.5814 15.0225 9.71307 15.9508 numMergedOcc 0
30 mol 134 unq 4 iso 0 dist 6.14652 7.07625 9.33094 10.4858 8.69531 6.81259 9.79337 7.41373 8.94367 9.86662 numMergedOcc 0
31 mol 134 unq 5 iso 0 dist 6.14652 7.07625 9.33094 10.4858 8.69531 6.81259 10.5814 10.8635 6.37586 9.71307 numMergedOcc 0
32 mol 134 unq 6 iso 0 dist 6.14652 7.07625 9.33094 10.4858 8.69531 6.81259 9.42271 12.3479 6.49416 12.5075 numMergedOcc 0
33 mol 134 unq 7 iso 0 dist 6.14652 10.4858 8.69531 7.07625 9.33094 6.81259 9.79337 7.41373 9.86662 8.94367 numMergedOcc 0
34 mol 134 unq 8 iso 0 dist 6.14652 10.4858 8.69531 7.07625 9.33094 6.81259 10.5814 10.8635 9.71307 6.37586 numMergedOcc 0
35 mol 152 unq 0 iso 0 dist 9.4275 5.65129 6.59889 10.5295 6.70693 7.65448 8.34839 5.39112 8.56324 6.70283 numMergedOcc 0
36 mol 152 unq 1 iso 0 dist 9.4275 10.5295 6.70693 5.65129 6.59889 7.65448 12.6531 4.94983 5.87555 10.399 numMergedOcc 0
37 mol 152 unq 2 iso 0 dist 9.4275 10.5295 6.70693 5.65129 6.59889 7.65448 8.34839 5.39112 6.70283 8.56324 numMergedOcc 0
38 mol 152 unq 3 iso 0 dist 9.4275 10.5295 6.70693 5.65129 6.59889 7.65448 14.5994 9.67475 8.67331 14.1618 numMergedOcc 0
39 mol 186 unq 0 iso 0 dist 9.00537 9.40374 6.61112 11.4985 8.90571 7.09479 10.8152 11.0961 7.54065 14.4482 numMergedOcc 0
40 mol 186 unq 1 iso 0 dist 8.9388 12.4751 6.61112 8.63909 8.90571 7.09479 18.4039 11.0961 7.54065 14.4482 numMergedOcc 0
41 mol 229 unq 0 iso 0 dist 9.90415 6.52416 7.27993 9.71486 9.51168 5.1556 6.32302 5.70473 8.22528 11.3979 numMergedOcc 0
42 mol 229 unq 1 iso 0 dist 9.90415 6.52416 7.27993 9.71486 9.51168 5.1556 6.88694 7.22525 7.03423 11.9282 numMergedOcc 0
43 mol 229 unq 2 iso 0 dist 9.90415 6.52416 7.27993 12.9522 6.95201 7.0298 6.32302 5.70473 8.22528 11.7165 numMergedOcc 0
44 mol 229 unq 3 iso 0 dist 9.90415 6.52416 7.27993 12.9522 6.95201 7.0298 6.88694 7.22525 7.03423 11.4362 numMergedOcc 0
45 mol 229 unq 4 iso 0 dist 9.90415 12.9522 6.95201 6.52416 7.27993 7.0298 13.808 4.61227 9.87838 11.6115 numMergedOcc 0
46 mol 229 unq 5 iso 0 dist 9.90415 12.9522 6.95201 9.71486 9.51168 6.54885 13.808 4.61227 9.87838 13.9028 numMergedOcc 0
47 mol 229 unq 6 iso 0 dist 5.96615 6.81165 7.27993 5.33253 9.51168 5.1556 8.53615 5.70473 8.22528 11.3979 numMergedOcc 0
48 mol 229 unq 7 iso 0 dist 5.96615 6.81165 7.27993 5.33253 9.51168 5.1556 11.0334 7.22525 7.03423 11.9282 numMergedOcc 0
49 mol 229 unq 8 iso 0 dist 5.96615 6.81165 7.27993 6.21905 6.95201 7.0298 8.53615 5.70473 8.22528 11.7165 numMergedOcc 0
50 mol 229 unq 9 iso 0 dist 5.96615 6.81165 7.27993 6.21905 6.95201 7.0298 11.0334 7.22525 7.03423 11.4362 numMergedOcc 0
51 mol 229 unq 10 iso 0 dist 5.96615 6.21905 6.95201 6.81165 7.27993 7.0298 9.97251 4.61227 9.87838 11.6115 numMergedOcc 0
52 mol 229 unq 11 iso 0 dist 5.96615 6.21905 6.95201 5.33253 9.51168 6.54885 9.97251 4.61227 9.87838 13.9028 numMergedOcc 0
53 mol 234 unq 0 iso 0 dist 9.73257 14.9272 7.81215 6.44395 5.64285 10.2693 21.1847 12.4252 9.45496 17.458 numMergedOcc 0
54 mol 234 unq 1 iso 0 dist 9.73257 14.9272 7.81215 6.44395 5.64285 10.2693 13.4679 5.75498 6.7625 10.701 numMergedOcc 0
55 mol 277 unq 0 iso 0 dist 7.88009 9.57081 8.9682 13.3794 9.57499 11.8268 16.2514 17.6038 9.7748 21.4606 numMergedOcc 0
56 mol 277 unq 1 iso 0 dist 7.88009 9.57081 8.9682 5.90394 5.46926 7.08227 16.2514 17.6038 9.7748 16.3537 numMergedOcc 0
57 mol 277 unq 2 iso 0 dist 5.80061 9.57081 6.92711 5.90394 5.13913 7.08227 16.2514 14.772 9.7748 16.3537 numMergedOcc 0
