0 mol 7 unq 0 iso 0 dist 8.75465 15.0884 9.87885 13.0935 12.8323 8.41585 17.7979 14.0737 5.0893 6.8464 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 6.6834 13.4994 7.95042 9.88461 5.69214 6.86014 16.9963 12.1911 11.4109 8.0319 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.74209 5.5249 6.6263 8.06275 5.41726 8.80331 9.83489 12.8366 14.0204 8.03754 numMergedOcc 0
3 mol 43 unq 1 iso 0 dist 8.74209 10.4413 6.75943 8.06275 5.41726 6.20293 9.83489 12.8366 13.1056 8.03754 numMergedOcc 0
4 mol 43 unq 2 iso 0 dist 8.74209 10.4413 6.75943 14.4184 10.0383 8.93915 17.692 15.6164 9.92508 9.47348 numMergedOcc 0
5 mol 43 unq 3 iso 0 dist 9.85555 5.46715 6.6263 13.5835 5.41726 8.80331 18.6634 12.8366 14.0204 8.03754 numMergedOcc 0
6 mol 43 unq 4 iso 0 dist 9.85555 12.902 6.75943 13.5835 5.41726 6.20293 18.6634 12.8366 13.1056 8.03754 numMergedOcc 0
7 mol 43 unq 5 iso 0 dist 9.85555 12.902 6.75943 19.4359 10.0383 8.93915 22.5831 15.6164 9.92508 9.47348 numMergedOcc 0
8 mol 95 unq 0 iso 0 dist 8.57607 4.16047 8.27883 11.3191 15.6249 8.03644 19.8239 22.8432 16.4832 9.64673 numMergedOcc 0
9 mol 95 unq 1 iso 0 dist 6.1991 4.16047 5.75428 11.3191 12.4896 8.03644 19.8239 21.3539 16.4832 9.64673 numMergedOcc 0
10 mol 95 unq 2 iso 0 dist 5.96246 4.16047 8.57395 11.3191 14.2178 8.03644 19.8239 23.6493 16.4832 9.64673 numMergedOcc 0
11 mol 109 unq 0 iso 0 dist 6.62354 5.68669 8.52024 9.26438 5.00433 8.69985 16.2476 14.206 12.7291 9.41191 numMergedOcc 0
12 mol 109 unq 1 iso 0 dist 8.00085 6.80429 8.52024 6.43255 5.00433 8.69985 9.88245 14.206 12.7291 9.41191 numMergedOcc 0
13 mol 115 unq 0 iso 0 dist 9.90992 12.718 7.69765 9.79979 4.48636 5.83991 10.7396 7.84768 4.75197 7.9258 numMergedOcc 0
14 mol 134 unq 0 iso 0 dist 7.76446 10.4858 9.1998 9.79337 12.8086 9.86662 15.6774 17.7356 9.66197 9.16358 numMergedOcc 0
15 mol 134 unq 1 iso 0 dist 7.76446 10.4858 9.1998 10.5814 15.0225 9.71307 15.6774 17.7356 9.66197 6.48328 numMergedOcc 0
16 mol 134 unq 2 iso 0 dist 6.14652 7.07625 9.33094 9.79337 7.41373 8.94367 15.6774 14.33 10.0911 9.16358 numMergedOcc 0
17 mol 134 unq 3 iso 0 dist 6.14652 7.07625 9.33094 10.5814 10.8635 6.37586 15.6774 14.33 10.0911 6.48328 numMergedOcc 0
18 mol 134 unq 4 iso 0 dist 6.14652 7.07625 9.33094 9.42271 12.3479 6.49416 10.9017 15.2447 6.65283 8.86784 numMergedOcc 0
19 mol 134 unq 5 iso 0 dist 6.14652 10.4858 8.69531 9.79337 7.41373 9.86662 15.6774 14.33 9.66197 9.16358 numMergedOcc 0
20 mol 134 unq 6 iso 0 dist 6.14652 10.4858 8.69531 10.5814 10.8635 9.71307 15.6774 14.33 9.66197 6.48328 numMergedOcc 0
21 mol 152 unq 0 iso 0 dist 9.4275 5.65129 6.59889 8.34839 5.39112 8.56324 8.6893 12.9285 13.1435 8.41774 numMergedOcc 0
22 mol 152 unq 1 iso 0 dist 9.4275 10.5295 6.70693 8.34839 5.39112 6.70283 8.6893 12.9285 13.793 8.41774 numMergedOcc 0
23 mol 152 unq 2 iso 0 dist 9.83462 5.65129 8.9192 8.34839 4.84714 8.56324 8.6893 11.2309 13.1435 8.41774 numMergedOcc 0
24 mol 182 unq 0 iso 0 dist 8.4603 5.4214 9.56028 11.8862 8.82964 9.31746 15.5539 16.4138 13.1207 9.06702 numMergedOcc 0
25 mol 205 unq 0 iso 0 dist 6.32553 9.40714 6.52816 16.4532 13.514 7.26832 10.5621 10.4944 5.04299 7.51951 numMergedOcc 0
26 mol 229 unq 0 iso 0 dist 9.90415 6.52416 7.27993 6.88694 7.22525 7.03423 5.19315 14.0673 9.15968 8.83023 numMergedOcc 0
27 mol 229 unq 1 iso 0 dist 5.96615 6.81165 7.27993 11.0334 7.22525 7.03423 14.4307 14.0673 9.15968 8.83023 numMergedOcc 0
