BKW7O3 -OEChem-04012119222D 45 48 0 1 0 0 0 0 0999 V2000 2.7314 -2.8287 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.1878 -0.8154 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4461 0.2087 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4461 2.2087 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3160 0.6812 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6720 0.2643 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4756 1.6687 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7141 0.2087 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7141 2.2087 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4519 0.1779 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5840 0.6746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4558 -0.8221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0480 0.6879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1840 0.1846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8480 0.7087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5917 -1.3254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3237 -1.3187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8480 1.7087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9541 0.1741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0480 1.7296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4678 -0.7146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4967 1.8728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9541 2.2434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5955 -2.3254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3276 -2.3187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4635 -2.8221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5801 0.7087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5801 1.7087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4495 0.7979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3136 1.3012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0535 -1.0175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8594 -1.0067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9613 -0.4459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3836 0.9377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5123 2.0416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8609 -0.5881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3413 -1.3216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0748 -0.8412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9613 2.8634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2423 2.4382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8657 -2.6267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7141 -0.4113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7141 2.8287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4659 -3.4421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 2 14 2 0 0 0 0 3 28 2 0 0 0 0 4 29 2 0 0 0 0 5 10 1 0 0 0 0 5 14 1 0 0 0 0 5 31 1 0 0 0 0 6 11 1 0 0 0 0 6 20 1 0 0 0 0 6 22 1 0 0 0 0 7 11 2 0 0 0 0 7 23 1 0 0 0 0 8 15 1 0 0 0 0 8 28 1 0 0 0 0 8 43 1 0 0 0 0 9 18 1 0 0 0 0 9 29 1 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 30 1 0 0 0 0 12 16 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 19 2 0 0 0 0 13 21 1 0 0 0 0 15 18 2 0 0 0 0 15 19 1 0 0 0 0 16 25 1 0 0 0 0 16 32 1 0 0 0 0 17 26 2 0 0 0 0 17 33 1 0 0 0 0 18 24 1 0 0 0 0 19 34 1 0 0 0 0 20 23 2 0 0 0 0 20 35 1 0 0 0 0 21 24 2 0 0 0 0 21 36 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 41 1 0 0 0 0 24 40 1 0 0 0 0 25 27 2 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 M END $$$$