0 mol 7 unq 0 iso 0 dist 8.00249 6.3236 7.67927 12.8676 11.143 7.10621 8.75465 4.80709 6.1206 7.12508 15.0884 14.1836 13.2247 10.5461 9.87885 numMergedOcc 0
1 mol 72 unq 0 iso 0 dist 9.20886 10.5933 7.66093 5.48831 7.07356 9.78528 11.3204 5.75711 6.21799 7.47371 11.4864 12.952 7.04035 10.8086 9.74228 numMergedOcc 0
2 mol 72 unq 1 iso 0 dist 9.20886 10.5933 7.66093 5.48831 7.07356 9.78528 11.3204 5.75711 6.21799 7.47371 13.0773 12.1131 8.24309 9.96708 7.12321 numMergedOcc 0
3 mol 72 unq 2 iso 0 dist 9.20886 10.5933 7.66093 5.48831 7.07356 9.78528 12.3271 5.26077 5.03251 9.67587 15.4881 13.336 5.8486 15.1902 9.56773 numMergedOcc 0
4 mol 95 unq 0 iso 0 dist 6.1991 4.16047 5.75428 7.90775 4.46005 9.03572 8.57607 6.27231 8.27883 4.99174 8.68514 10.0848 6.59884 11.5113 7.7152 numMergedOcc 0
5 mol 95 unq 1 iso 0 dist 6.1991 4.16047 5.75428 9.96562 3.94293 8.83255 8.57607 6.27231 8.27883 8.67311 8.68514 10.0848 6.59884 12.9844 7.7152 numMergedOcc 0
6 mol 95 unq 2 iso 0 dist 6.1991 4.16047 5.75428 11.3191 12.4896 8.03644 8.57607 6.27231 8.27883 15.6249 8.68514 10.0848 6.59884 11.3446 7.7152 numMergedOcc 0
7 mol 95 unq 3 iso 0 dist 5.96246 4.16047 8.57395 7.90775 8.28518 9.03572 8.57607 11.734 8.27883 4.99174 8.68514 14.2618 6.59884 11.5113 7.7152 numMergedOcc 0
8 mol 95 unq 4 iso 0 dist 5.96246 4.16047 8.57395 9.96562 9.22202 8.83255 8.57607 11.734 8.27883 8.67311 8.68514 14.2618 6.59884 12.9844 7.7152 numMergedOcc 0
9 mol 95 unq 5 iso 0 dist 5.96246 4.16047 8.57395 11.3191 14.2178 8.03644 8.57607 11.734 8.27883 15.6249 8.68514 14.2618 6.59884 11.3446 7.7152 numMergedOcc 0
10 mol 98 unq 0 iso 0 dist 5.91797 9.41666 7.54889 9.32725 10.4782 6.10456 6.37954 6.70343 5.2571 3.9764 5.90686 9.81956 8.40073 5.08437 5.10496 numMergedOcc 0
11 mol 98 unq 1 iso 0 dist 5.91797 9.41666 7.54889 9.32725 10.4782 6.10456 6.37954 6.70343 5.2571 3.9764 11.2946 10.8223 9.42358 6.48948 5.92242 numMergedOcc 0
12 mol 98 unq 2 iso 0 dist 5.91797 9.41666 7.54889 9.32725 10.4782 6.10456 6.37954 6.70343 5.2571 3.9764 9.57791 7.78931 5.02887 10.1136 8.7497 numMergedOcc 0
13 mol 98 unq 3 iso 0 dist 6.37954 9.41666 5.2571 9.32725 3.9764 6.10456 5.91797 6.70343 7.54889 10.4782 15.3018 14.0897 13.659 17.4071 9.64383 numMergedOcc 0
14 mol 98 unq 4 iso 0 dist 6.37954 9.41666 5.2571 9.32725 3.9764 6.10456 5.91797 6.70343 7.54889 10.4782 9.57791 8.7497 5.02887 10.1136 7.78931 numMergedOcc 0
15 mol 109 unq 0 iso 0 dist 8.59103 8.36322 6.29161 11.7396 6.73011 7.34473 10.3079 7.49425 7.86666 13.0886 19.3937 15.7676 17.2949 21.5605 9.77497 numMergedOcc 0
16 mol 115 unq 0 iso 0 dist 9.90992 12.718 7.69765 18.5013 10.3209 7.30858 12.5218 11.044 9.42082 15.3161 14.8263 13.4105 7.69052 13.8473 6.39384 numMergedOcc 0
17 mol 115 unq 1 iso 0 dist 9.90992 12.718 7.69765 9.79979 4.48636 5.83991 12.5218 11.044 9.42082 6.63111 14.8263 13.4105 7.69052 9.33865 6.39384 numMergedOcc 0
18 mol 115 unq 2 iso 0 dist 9.90992 12.718 7.69765 16.7328 11.835 7.88312 12.5218 11.044 9.42082 6.07067 14.8263 13.4105 7.69052 6.11741 6.39384 numMergedOcc 0
19 mol 134 unq 0 iso 0 dist 7.76446 10.4858 9.1998 9.79337 12.8086 9.86662 6.14652 5.83782 8.69531 7.41373 7.07625 11.0808 6.81259 8.94367 9.33094 numMergedOcc 0
20 mol 134 unq 1 iso 0 dist 7.76446 10.4858 9.1998 10.5814 15.0225 9.71307 6.14652 5.83782 8.69531 10.8635 7.07625 11.0808 6.81259 6.37586 9.33094 numMergedOcc 0
21 mol 134 unq 2 iso 0 dist 6.14652 10.4858 8.69531 9.79337 7.41373 9.86662 7.76446 5.83782 9.1998 12.8086 6.47007 9.70973 11.6064 15.281 6.42772 numMergedOcc 0
22 mol 134 unq 3 iso 0 dist 6.14652 10.4858 8.69531 9.79337 7.41373 9.86662 7.76446 5.83782 9.1998 12.8086 14.3375 10.3432 7.09823 14.0375 8.70621 numMergedOcc 0
23 mol 134 unq 4 iso 0 dist 6.14652 10.4858 8.69531 10.5814 10.8635 9.71307 7.76446 5.83782 9.1998 15.0225 6.47007 9.70973 11.6064 15.6507 6.42772 numMergedOcc 0
24 mol 134 unq 5 iso 0 dist 6.14652 10.4858 8.69531 10.5814 10.8635 9.71307 7.76446 5.83782 9.1998 15.0225 14.3375 10.3432 7.09823 15.9508 8.70621 numMergedOcc 0
25 mol 152 unq 0 iso 0 dist 9.83462 5.65129 8.9192 8.34839 4.84714 8.56324 9.4275 3.55572 6.59889 5.39112 10.5295 9.27706 7.65448 6.70283 6.70693 numMergedOcc 0
26 mol 277 unq 0 iso 0 dist 7.88009 9.57081 8.9682 16.2514 17.6038 9.7748 5.80061 3.39114 6.92711 14.772 5.90394 5.46926 7.08227 16.3537 5.13913 numMergedOcc 0
27 mol 277 unq 1 iso 0 dist 5.80061 9.57081 6.92711 16.2514 14.772 9.7748 7.88009 3.39114 8.9682 17.6038 13.3794 11.4389 11.8268 21.4606 9.57499 numMergedOcc 0
28 mol 277 unq 2 iso 0 dist 5.80061 9.57081 6.92711 16.2514 14.772 9.7748 7.88009 3.39114 8.9682 17.6038 5.90394 5.13913 7.08227 16.3537 5.46926 numMergedOcc 0
29 mol 292 unq 0 iso 0 dist 7.48212 5.0721 7.20674 10.0145 7.8414 8.2734 11.097 9.14614 8.38121 14.179 9.6377 10.1532 11.8061 17.2013 9.90967 numMergedOcc 0
