B5Q2BR -OEChem-04022105482D 44 47 0 0 0 0 0 0 0999 V2000 4.4727 1.0668 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.8294 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4432 2.5613 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1756 -2.4025 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6636 2.4681 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0416 -4.9025 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3666 -1.8147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6756 -0.8637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9846 -1.8147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6756 -0.8637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1756 -3.4025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0878 -0.0546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4155 -2.1237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9356 -2.1237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4945 0.8589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 1.7249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3096 -3.9025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0416 -3.9025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4557 3.4462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5772 2.0613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3096 -4.9025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1989 4.1153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5047 3.7552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1756 -5.4025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9910 5.0935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2968 4.7334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0399 5.4025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0400 -0.3621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4712 -0.1195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2239 -1.5341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8258 -2.3153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6071 -2.7134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7440 -2.7134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5253 -2.3153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1272 -1.5341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7726 -3.5925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5785 -3.5925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7726 -5.2125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7885 3.9238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0439 3.3404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1756 -6.0225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4517 5.5084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7071 4.9250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9110 6.0090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 20 1 0 0 0 0 2 16 2 0 0 0 0 3 20 2 0 0 0 0 4 7 1 0 0 0 0 4 9 1 0 0 0 0 4 11 1 0 0 0 0 5 16 1 0 0 0 0 5 19 1 0 0 0 0 5 20 1 0 0 0 0 6 18 1 0 0 0 0 6 24 2 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 28 1 0 0 0 0 11 17 1 0 0 0 0 11 18 2 0 0 0 0 12 15 2 0 0 0 0 12 29 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 17 21 2 0 0 0 0 17 36 1 0 0 0 0 18 37 1 0 0 0 0 19 22 2 0 0 0 0 19 23 1 0 0 0 0 21 24 1 0 0 0 0 21 38 1 0 0 0 0 22 25 1 0 0 0 0 22 39 1 0 0 0 0 23 26 2 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 25 27 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 M END $$$$