0 mol 8 unq 0 iso 0 dist 6.82379 6.56356 8.64248 11.0223 5.00267 13.4523 10.9495 10.6335 9.01112 12.9353 9.88063 5.02333 9.68798 7.8922 13.9804 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 6.82379 6.56356 8.64248 11.0223 5.00267 13.4523 8.09332 11.7258 7.62333 15.199 9.88063 5.02333 9.68798 7.8922 15.2476 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 9.93832 6.6263 4.55347 7.05402 7.31982 7.15901 8.13395 8.60739 6.75943 5.48048 10.5523 5.64171 4.96926 8.44903 5.73819 numMergedOcc 0
3 mol 43 unq 1 iso 0 dist 8.60739 6.75943 4.55347 5.48048 7.31982 7.15901 8.13395 9.93832 6.6263 7.05402 5.73819 5.64171 4.96926 8.44903 10.5523 numMergedOcc 0
4 mol 115 unq 0 iso 0 dist 5.72642 9.42082 10.5109 7.21418 8.71286 10.3973 7.69052 10.9734 6.39384 6.08806 7.88312 7.3094 6.07067 5.74857 6.11741 numMergedOcc 0
5 mol 119 unq 0 iso 0 dist 7.99857 6.99446 6.29394 4.99056 8.03035 9.57341 10.9871 14.6439 8.95212 13.52 10.3704 4.91132 9.68677 7.77116 16.4353 numMergedOcc 0
6 mol 119 unq 1 iso 0 dist 7.99857 6.99446 6.29394 4.99056 8.03035 9.57341 4.85907 8.56342 7.64052 3.78311 10.3704 4.91132 9.68677 7.77116 8.73993 numMergedOcc 0
7 mol 119 unq 2 iso 0 dist 8.56342 7.64052 6.29394 3.78311 8.03035 9.57341 9.93257 14.6439 8.95212 13.52 8.73993 4.91132 9.68677 7.77116 16.4353 numMergedOcc 0
8 mol 119 unq 3 iso 0 dist 8.56342 7.64052 6.29394 3.78311 8.03035 9.57341 4.85907 7.99857 6.99446 4.99056 8.73993 4.91132 9.68677 7.77116 10.3704 numMergedOcc 0
9 mol 119 unq 4 iso 0 dist 6.37542 7.64052 9.64502 3.78311 7.6968 9.57341 9.93257 12.8836 8.95212 13.52 8.73993 6.08167 9.68677 7.77116 16.4353 numMergedOcc 0
10 mol 119 unq 5 iso 0 dist 6.37542 7.64052 9.64502 3.78311 7.6968 9.57341 4.85907 10.4631 6.99446 4.99056 8.73993 6.08167 9.68677 7.77116 10.3704 numMergedOcc 0
11 mol 152 unq 0 iso 0 dist 9.77552 6.59889 4.71678 7.2238 6.39031 7.1069 7.65448 8.28642 6.70693 5.59336 10.399 5.70788 4.94983 8.35555 5.87555 numMergedOcc 0
12 mol 152 unq 1 iso 0 dist 8.28642 6.70693 4.71678 5.59336 6.39031 7.1069 7.65448 9.77552 6.59889 7.2238 5.87555 5.70788 4.94983 8.35555 10.399 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 7.20574 6.61112 8.58039 12.7155 7.55358 14.0095 7.09479 12.6244 8.90571 15.3675 16.1971 9.27818 14.6223 9.56197 20.5615 numMergedOcc 0
14 mol 186 unq 1 iso 0 dist 7.20574 6.61112 8.58039 12.7155 7.55358 14.0095 7.09479 12.6244 8.90571 15.3675 18.5854 13.0197 17.6047 7.24795 20.169 numMergedOcc 0
15 mol 186 unq 2 iso 0 dist 7.20574 6.61112 8.58039 12.7155 7.55358 14.0095 7.09479 12.6244 8.90571 15.3675 10.7914 4.37002 12.4091 8.64409 16.8032 numMergedOcc 0
16 mol 186 unq 3 iso 0 dist 7.20574 6.61112 8.58039 12.7155 7.55358 14.0095 7.09479 12.6244 8.90571 15.3675 16.7729 9.72941 17.4532 7.60202 21.4034 numMergedOcc 0
17 mol 225 unq 0 iso 0 dist 6.6561 6.50998 6.35462 4.76151 6.53728 9.87668 13.3965 11.5332 8.1945 16.6392 13.3684 11.5135 17.3148 8.87609 22.4468 numMergedOcc 0
18 mol 227 unq 0 iso 0 dist 8.38865 5.23634 7.3164 10.5813 9.56257 9.43618 5.22356 5.4694 6.91318 7.22396 7.22101 11.0628 5.0317 8.03442 8.65997 numMergedOcc 0
19 mol 227 unq 1 iso 0 dist 5.4694 6.91318 7.3164 7.22396 9.56257 9.43618 5.22356 8.38865 5.23634 10.5813 8.65997 11.0628 5.0317 8.03442 7.22101 numMergedOcc 0
20 mol 238 unq 0 iso 0 dist 7.32982 9.72188 13.0611 10.7551 9.89583 6.53286 15.7907 17.2012 9.12776 11.0349 12.2442 14.1055 4.48415 5.52379 11.5794 numMergedOcc 0
21 mol 238 unq 1 iso 0 dist 5.52379 6.99888 5.63944 14.1055 9.89583 15.0962 10.1813 11.9624 9.08509 20.9702 13.6591 10.7508 15.3952 6.66971 22.5825 numMergedOcc 0
22 mol 238 unq 2 iso 0 dist 5.52379 6.99888 5.63944 14.1055 9.89583 15.0962 10.1813 11.9624 9.08509 20.9702 10.0419 5.87253 10.2642 6.4398 17.805 numMergedOcc 0
23 mol 238 unq 3 iso 0 dist 5.52379 6.99888 5.63944 14.1055 9.89583 15.0962 10.1813 11.9624 9.08509 20.9702 12.2442 10.7551 16.2734 7.32982 19.5656 numMergedOcc 0
24 mol 264 unq 0 iso 0 dist 7.52281 5.90924 7.36132 4.48907 5.74568 7.14086 7.07277 12.2392 5.90058 9.09085 10.4298 6.84156 11.4167 6.04162 14.2152 numMergedOcc 0
25 mol 264 unq 1 iso 0 dist 7.52281 5.90924 7.36132 4.48907 5.74568 7.14086 7.07277 12.2392 5.90058 9.09085 9.90113 9.37297 13.2035 6.14323 14.5869 numMergedOcc 0
26 mol 264 unq 2 iso 0 dist 7.52281 5.90924 7.36132 4.48907 5.74568 7.14086 8.96144 6.42588 9.58916 10.1591 10.4298 6.84156 11.4167 6.04162 12.864 numMergedOcc 0
27 mol 264 unq 3 iso 0 dist 7.52281 5.90924 7.36132 4.48907 5.74568 7.14086 8.96144 6.42588 9.58916 10.1591 9.90113 9.37297 13.2035 6.14323 13.9815 numMergedOcc 0
28 mol 264 unq 4 iso 0 dist 6.42588 9.58916 7.36132 10.1591 5.74568 7.14086 8.96144 7.52281 5.90924 4.48907 12.864 6.84156 11.4167 6.04162 10.4298 numMergedOcc 0
29 mol 264 unq 5 iso 0 dist 6.42588 9.58916 7.36132 10.1591 5.74568 7.14086 8.96144 7.52281 5.90924 4.48907 13.9815 9.37297 13.2035 6.14323 9.90113 numMergedOcc 0
30 mol 264 unq 6 iso 0 dist 6.42588 9.58916 7.36132 10.1591 5.74568 7.14086 14.3597 12.2392 5.90058 9.09085 12.864 6.84156 11.4167 6.04162 14.2152 numMergedOcc 0
31 mol 264 unq 7 iso 0 dist 6.42588 9.58916 7.36132 10.1591 5.74568 7.14086 14.3597 12.2392 5.90058 9.09085 13.9815 9.37297 13.2035 6.14323 14.5869 numMergedOcc 0
32 mol 264 unq 8 iso 0 dist 6.04162 9.19754 5.82131 6.84156 5.74568 6.02757 4.92077 6.14323 8.29262 9.37297 10.4298 4.48907 5.71153 7.52281 9.90113 numMergedOcc 0
33 mol 264 unq 9 iso 0 dist 6.04162 9.19754 5.82131 6.84156 5.74568 6.02757 4.92077 6.14323 8.29262 9.37297 12.864 10.1591 6.56539 6.42588 13.9815 numMergedOcc 0
34 mol 264 unq 10 iso 0 dist 6.14323 8.29262 5.82131 9.37297 5.74568 6.02757 4.92077 6.04162 9.19754 6.84156 9.90113 4.48907 5.71153 7.52281 10.4298 numMergedOcc 0
35 mol 264 unq 11 iso 0 dist 6.14323 8.29262 5.82131 9.37297 5.74568 6.02757 4.92077 6.04162 9.19754 6.84156 13.9815 10.1591 6.56539 6.42588 12.864 numMergedOcc 0
