B4GEA6 -OEChem-04012118362D 37 39 0 0 0 0 0 0 0999 V2000 4.4809 -1.0849 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.0687 -2.0080 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7680 1.6921 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0687 -2.0080 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0687 -0.2759 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1208 2.2273 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6565 -1.1989 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6565 -2.8170 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6075 -2.5080 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5836 0.5288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.2759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5298 0.2241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5836 -1.0806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5298 -0.7759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4809 0.5331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0687 -0.2759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7899 1.4842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5687 -1.1419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5687 -1.1419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0687 -2.0080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3474 -0.2479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6075 -1.5079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8346 1.0957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0462 0.8381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5391 0.1388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5391 -0.6906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0462 -1.3899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8346 -1.6475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3787 0.2610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1513 -0.9299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4610 -0.5313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3124 2.8170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5143 2.0984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9371 -0.0563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1558 0.3418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7578 -0.4395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1091 -1.1435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 16 1 0 0 0 0 2 19 1 0 0 0 0 2 20 1 0 0 0 0 3 17 2 0 0 0 0 4 18 2 0 0 0 0 5 16 1 0 0 0 0 5 18 1 0 0 0 0 5 29 1 0 0 0 0 6 17 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 20 2 0 0 0 0 9 22 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 11 13 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 1 0 0 0 0 19 30 1 0 0 0 0 19 31 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 22 37 1 0 0 0 0 M END $$$$