B4KSN6 -OEChem-04022100422D 43 44 0 0 0 0 0 0 0999 V2000 4.3211 1.3684 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 0.8304 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -1.9358 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9280 -0.9901 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 1.7809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6353 0.0861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6138 0.2923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2816 -0.4520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 0.6241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -0.3264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 1.9871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6103 2.5252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.6311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2601 -0.2458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.6311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -1.1311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.1311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.1311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.6311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.6311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6714 1.6530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1089 -0.2416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8665 -0.4892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1402 0.6199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3825 0.8675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7553 -0.7797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5129 -1.0273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3845 1.3804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8633 2.1150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1288 2.5938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0717 2.9392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 2.9866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1488 2.1111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7865 0.0818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0289 0.3294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8819 -1.1311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 -2.5252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.4889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.7511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.3211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.9411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5347 -0.8623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7354 -1.5794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 2 0 0 0 0 2 5 1 0 0 0 0 2 6 1 0 0 0 0 2 9 1 0 0 0 0 3 15 1 0 0 0 0 3 16 1 0 0 0 0 3 37 1 0 0 0 0 4 14 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 14 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 10 13 1 0 0 0 0 10 16 2 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 15 1 0 0 0 0 13 17 2 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 18 2 0 0 0 0 16 36 1 0 0 0 0 17 19 1 0 0 0 0 17 38 1 0 0 0 0 18 20 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 M END $$$$