0 mol 1 unq 0 iso 0 dist 9.00903 9.12196 7.4817 7.94662 6.09918 7.73435 14.3332 5.92202 10.5521 8.26708 10.8992 4.50502 11.6921 7.27254 6.27888 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 6.86014 6.60423 6.00575 6.58998 10.7114 9.38831 8.86116 10.0952 5.97304 6.72502 7.95042 5.69214 4.47891 8.24948 5.11636 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 5.54419 4.93188 4.33963 9.48345 11.2485 9.40479 13.2433 14.6259 11.2106 6.72502 10.9113 13.6174 9.57743 8.24948 5.11636 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 7.36323 9.24958 4.33963 13.1456 11.2485 9.40479 15.5296 14.6259 11.2106 6.72502 16.707 13.6174 9.57743 8.24948 5.11636 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 5.73819 8.44903 5.48048 5.64171 8.60739 7.31982 10.5523 8.13395 7.05402 9.93832 6.66407 5.07458 4.69849 7.24352 10.8828 numMergedOcc 0
5 mol 43 unq 1 iso 0 dist 8.80331 9.93832 9.06158 7.05402 10.0649 7.31982 10.5523 5.06502 5.64171 8.44903 6.6263 5.41726 4.55347 7.15901 4.96926 numMergedOcc 0
6 mol 43 unq 2 iso 0 dist 6.20293 8.60739 9.06158 5.48048 10.0649 7.31982 5.73819 5.06502 5.64171 8.44903 6.75943 5.41726 4.55347 7.15901 4.96926 numMergedOcc 0
7 mol 43 unq 3 iso 0 dist 8.93915 8.60739 11.3891 5.48048 13.5072 7.31982 5.73819 5.89973 5.64171 8.44903 6.75943 10.0383 4.55347 7.15901 4.96926 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 6.11741 5.74857 6.08806 7.3094 10.9734 8.71286 7.88312 7.69052 7.21418 5.72642 11.8378 11.1447 8.80697 8.4965 5.03039 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 9.87172 7.99857 7.61939 4.99056 13.1741 8.03035 10.3704 12.4603 4.91132 7.77116 11.2897 12.4621 6.71103 9.6121 6.9194 numMergedOcc 0
10 mol 119 unq 1 iso 0 dist 9.87172 7.99857 7.61939 4.99056 13.1741 8.03035 10.3704 12.4603 4.91132 7.77116 6.99446 6.20019 6.29394 9.57341 9.68677 numMergedOcc 0
11 mol 152 unq 0 iso 0 dist 5.87555 8.35555 5.59336 5.70788 8.28642 6.39031 10.399 7.65448 7.2238 9.77552 10.4285 9.84297 5.55763 6.92726 12.4535 numMergedOcc 0
12 mol 152 unq 1 iso 0 dist 8.87437 8.35555 10.9728 5.70788 13.1536 6.39031 10.399 10.6875 7.2238 9.77552 10.4285 15.1669 5.55763 6.92726 12.4535 numMergedOcc 0
13 mol 152 unq 2 iso 0 dist 8.87437 8.35555 10.9728 5.70788 13.1536 6.39031 5.87555 5.49936 5.59336 8.28642 10.4285 15.1669 5.55763 6.92726 9.84297 numMergedOcc 0
14 mol 152 unq 3 iso 0 dist 8.56324 9.77552 9.35627 7.2238 10.4911 6.39031 10.399 5.42328 5.70788 8.35555 6.59889 5.39112 4.71678 7.1069 4.94983 numMergedOcc 0
15 mol 152 unq 4 iso 0 dist 6.70283 8.28642 9.35627 5.59336 10.4911 6.39031 5.87555 5.42328 5.70788 8.35555 6.70693 5.39112 4.71678 7.1069 4.94983 numMergedOcc 0
16 mol 152 unq 5 iso 0 dist 8.67331 8.28642 11.2078 5.59336 13.0858 6.39031 5.87555 5.54906 5.70788 8.35555 6.70693 9.67475 4.71678 7.1069 4.94983 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 7.54065 7.20574 8.90184 12.7155 15.9107 7.55358 16.1971 16.4637 9.27818 9.56197 19.553 21.5459 13.0608 8.57801 6.89047 numMergedOcc 0
18 mol 186 unq 1 iso 0 dist 7.54065 7.20574 8.90184 12.7155 15.9107 7.55358 18.5854 21.886 13.0197 7.24795 19.553 21.5459 13.0608 8.57801 3.90244 numMergedOcc 0
19 mol 186 unq 2 iso 0 dist 7.54065 7.20574 8.90184 12.7155 15.9107 7.55358 10.7914 9.50685 4.37002 8.64409 19.553 21.5459 13.0608 8.57801 12.6058 numMergedOcc 0
20 mol 186 unq 3 iso 0 dist 7.54065 7.20574 8.90184 12.7155 15.9107 7.55358 16.7729 16.6762 9.72941 7.60202 19.553 21.5459 13.0608 8.57801 7.21555 numMergedOcc 0
21 mol 186 unq 4 iso 0 dist 8.87694 6.85302 8.90184 9.97575 15.9107 7.55358 15.6447 16.4637 9.27818 9.56197 17.9507 21.5459 13.0608 8.57801 6.89047 numMergedOcc 0
22 mol 186 unq 5 iso 0 dist 8.87694 6.85302 8.90184 9.97575 15.9107 7.55358 16.9992 21.886 13.0197 7.24795 17.9507 21.5459 13.0608 8.57801 3.90244 numMergedOcc 0
23 mol 186 unq 6 iso 0 dist 8.87694 6.85302 8.90184 9.97575 15.9107 7.55358 9.09754 9.50685 4.37002 8.64409 17.9507 21.5459 13.0608 8.57801 12.6058 numMergedOcc 0
24 mol 186 unq 7 iso 0 dist 8.87694 6.85302 8.90184 9.97575 15.9107 7.55358 14.1487 16.6762 9.72941 7.60202 17.9507 21.5459 13.0608 8.57801 7.21555 numMergedOcc 0
25 mol 186 unq 8 iso 0 dist 8.87694 9.98215 12.8303 9.97575 15.9107 7.60991 15.6447 16.4637 9.55926 9.56197 17.9507 21.5459 11.868 8.57801 6.89047 numMergedOcc 0
26 mol 186 unq 9 iso 0 dist 8.87694 9.98215 12.8303 9.97575 15.9107 7.60991 16.9992 21.886 12.9082 7.24795 17.9507 21.5459 11.868 8.57801 3.90244 numMergedOcc 0
27 mol 186 unq 10 iso 0 dist 8.87694 9.98215 12.8303 9.97575 15.9107 7.60991 9.09754 9.50685 4.64235 8.64409 17.9507 21.5459 11.868 8.57801 12.6058 numMergedOcc 0
28 mol 186 unq 11 iso 0 dist 8.87694 9.98215 12.8303 9.97575 15.9107 7.60991 14.1487 16.6762 5.39885 7.60202 17.9507 21.5459 11.868 8.57801 7.21555 numMergedOcc 0
29 mol 186 unq 12 iso 0 dist 9.09754 6.85302 4.37002 9.97575 8.64409 7.55358 15.6447 8.04815 9.27818 9.56197 17.9507 12.6058 13.0608 8.57801 6.89047 numMergedOcc 0
30 mol 186 unq 13 iso 0 dist 9.09754 6.85302 4.37002 9.97575 8.64409 7.55358 16.9992 13.684 13.0197 7.24795 17.9507 12.6058 13.0608 8.57801 3.90244 numMergedOcc 0
31 mol 186 unq 14 iso 0 dist 9.09754 6.85302 4.37002 9.97575 8.64409 7.55358 14.1487 7.18269 9.72941 7.60202 17.9507 12.6058 13.0608 8.57801 7.21555 numMergedOcc 0
32 mol 186 unq 15 iso 0 dist 9.09754 9.98215 4.64235 9.97575 8.64409 7.60991 15.6447 8.04815 9.55926 9.56197 17.9507 12.6058 11.868 8.57801 6.89047 numMergedOcc 0
33 mol 186 unq 16 iso 0 dist 9.09754 9.98215 4.64235 9.97575 8.64409 7.60991 16.9992 13.684 12.9082 7.24795 17.9507 12.6058 11.868 8.57801 3.90244 numMergedOcc 0
34 mol 186 unq 17 iso 0 dist 9.09754 9.98215 4.64235 9.97575 8.64409 7.60991 14.1487 7.18269 5.39885 7.60202 17.9507 12.6058 11.868 8.57801 7.21555 numMergedOcc 0
35 mol 227 unq 0 iso 0 dist 9.34734 8.03442 10.2525 11.0628 12.9778 9.56257 7.22101 6.99063 10.5813 8.38865 9.91384 10.012 11.2819 5.28771 4.1511 numMergedOcc 0
36 mol 227 unq 1 iso 0 dist 9.34734 8.03442 10.2525 11.0628 12.9778 9.56257 8.65997 7.60506 7.22396 5.4694 9.91384 10.012 11.2819 5.28771 4.69247 numMergedOcc 0
37 mol 227 unq 2 iso 0 dist 7.22101 8.03442 10.5813 11.0628 8.38865 9.56257 8.65997 5.22356 7.22396 5.4694 9.91384 4.1511 11.2819 5.28771 4.69247 numMergedOcc 0
38 mol 227 unq 3 iso 0 dist 8.65997 8.03442 7.22396 11.0628 5.4694 9.56257 7.22101 5.22356 10.5813 8.38865 9.91384 4.69247 11.2819 5.28771 4.1511 numMergedOcc 0
39 mol 227 unq 4 iso 0 dist 7.56888 8.03442 6.10296 11.0628 13.9676 9.56257 7.22101 10.8658 10.5813 8.38865 9.91384 13.4494 11.2819 5.28771 4.1511 numMergedOcc 0
40 mol 227 unq 5 iso 0 dist 7.56888 8.03442 6.10296 11.0628 13.9676 9.56257 8.65997 9.70012 7.22396 5.4694 9.91384 13.4494 11.2819 5.28771 4.69247 numMergedOcc 0
41 mol 227 unq 6 iso 0 dist 7.55216 8.03442 9.69537 11.0628 16.9219 9.56257 7.22101 12.4689 10.5813 8.38865 9.91384 15.7786 11.2819 5.28771 4.1511 numMergedOcc 0
42 mol 227 unq 7 iso 0 dist 7.55216 8.03442 9.69537 11.0628 16.9219 9.56257 8.65997 12.9332 7.22396 5.4694 9.91384 15.7786 11.2819 5.28771 4.69247 numMergedOcc 0
43 mol 227 unq 8 iso 0 dist 7.09863 8.38865 12.9587 10.5813 12.2278 9.56257 7.22101 4.39704 11.0628 8.03442 5.23634 5.83175 7.3164 9.43618 5.0317 numMergedOcc 0
44 mol 238 unq 0 iso 0 dist 5.72887 7.32982 12.3808 10.7551 11.2809 9.89583 12.2442 10.027 14.1055 5.52379 9.72188 7.06793 13.0611 6.53286 4.48415 numMergedOcc 0
45 mol 252 unq 0 iso 0 dist 7.19638 6.86945 5.25252 7.63376 7.50201 8.55481 10.5136 6.0987 6.28227 6.53679 7.15764 7.40852 4.34126 5.9974 5.6214 numMergedOcc 0
46 mol 264 unq 0 iso 0 dist 9.17653 6.14323 13.0621 9.37297 15.2775 5.74568 9.90113 14.4574 4.48907 7.52281 8.29262 10.7813 5.82131 6.02757 5.71153 numMergedOcc 0
47 mol 264 unq 1 iso 0 dist 9.17653 6.14323 13.0621 9.37297 15.2775 5.74568 9.90113 14.4574 4.48907 7.52281 13.4196 14.66 9.58444 8.67231 6.87635 numMergedOcc 0
48 mol 264 unq 2 iso 0 dist 9.17653 6.14323 13.0621 9.37297 15.2775 5.74568 13.9815 16.6464 10.1591 6.42588 8.29262 10.7813 5.82131 6.02757 6.56539 numMergedOcc 0
49 mol 264 unq 3 iso 0 dist 9.17653 6.14323 13.0621 9.37297 15.2775 5.74568 13.9815 16.6464 10.1591 6.42588 13.4196 14.66 9.58444 8.67231 4.76241 numMergedOcc 0
