B5V2EO -OEChem-04012118392D 40 43 0 0 0 0 0 0 0999 V2000 4.3733 -2.7518 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6978 -0.2678 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8785 0.5686 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1759 -0.9259 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7910 -2.0473 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9021 2.1226 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8247 0.2639 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8247 1.8734 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2804 0.0686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3669 0.4754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1464 0.5686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 1.4535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1978 -1.1338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0125 0.0686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1464 1.5686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8785 1.5686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0125 2.0686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2079 1.7625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6942 3.1008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.7407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7431 3.4098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4083 1.0686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3788 -2.8564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4374 3.7699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9721 -3.7699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0812 -0.2030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0125 -0.5514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6095 1.8786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0125 2.6886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7472 1.3477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1744 -2.1122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4103 2.9323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6142 4.0162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0283 1.0686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8522 3.3092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8981 4.1848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0225 4.2307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4057 -3.5177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7199 -4.3363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5385 -4.0221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 2 0 0 0 0 2 10 1 0 0 0 0 2 13 1 0 0 0 0 2 26 1 0 0 0 0 3 7 1 0 0 0 0 3 14 1 0 0 0 0 3 16 1 0 0 0 0 4 9 1 0 0 0 0 4 13 2 0 0 0 0 5 13 1 0 0 0 0 5 23 1 0 0 0 0 5 31 1 0 0 0 0 6 12 1 0 0 0 0 6 19 2 0 0 0 0 7 22 2 0 0 0 0 8 16 2 0 0 0 0 8 22 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 10 12 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 12 18 2 0 0 0 0 14 27 1 0 0 0 0 15 17 2 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 17 29 1 0 0 0 0 18 20 1 0 0 0 0 18 30 1 0 0 0 0 19 21 1 0 0 0 0 19 24 1 0 0 0 0 20 21 2 0 0 0 0 20 32 1 0 0 0 0 21 33 1 0 0 0 0 22 34 1 0 0 0 0 23 25 1 0 0 0 0 24 35 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 M END $$$$