B4RSC8 -OEChem-04022102183D 56 59 0 1 0 0 0 0 0999 V2000 -0.6555 -0.5278 1.6023 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5934 -0.4450 -1.4775 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5051 0.2359 0.0186 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6835 -0.1513 -1.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1924 1.3553 0.4520 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1369 -1.6721 -0.2735 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5158 1.1158 0.6072 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 1.2487 0.6950 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.3952 0.5073 0.5530 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7161 2.0218 -0.5907 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.5291 1.5211 0.2054 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3023 2.4985 -0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7823 0.5136 0.9831 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7926 2.9982 -0.9193 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3281 -0.5727 -0.4967 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0666 2.7520 -0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2276 1.9855 1.4896 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1918 -2.7965 -1.1962 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0240 -1.8858 0.8656 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9214 -3.8859 -0.4255 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8635 -3.0928 0.4714 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1883 0.3523 -0.3272 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3188 -0.5354 -0.8724 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7255 -0.5635 -0.3509 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6338 0.4210 -0.7399 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1248 -1.5746 0.5231 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9414 0.3945 -0.2551 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4324 -1.6012 1.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3408 -0.6166 0.6189 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1822 1.9590 1.5322 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5879 0.0349 1.5225 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5838 1.3967 -1.4768 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2866 1.0230 -0.4143 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2932 2.6833 -1.1732 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2841 3.3758 0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5489 3.8834 -1.4972 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8313 3.4683 -0.8586 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5373 2.5177 2.1535 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6403 1.1370 2.0445 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0592 2.6619 1.2614 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1869 -3.0917 -1.5121 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7600 -2.4766 -2.0766 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4041 -2.1040 1.7418 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6424 -1.0087 1.0639 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2115 -4.4505 0.1908 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4434 -4.5887 -1.0804 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7384 -2.7696 -0.1056 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2139 -3.6631 1.3359 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 1.5162 1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2957 -0.0893 -1.8745 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9222 -1.5556 -0.9465 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3340 1.2150 -1.4187 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4258 -2.3460 0.8352 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6486 1.1614 -0.5576 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7433 -2.3881 1.6889 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3588 -0.6372 0.9966 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 15 2 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 22 2 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 5 13 1 0 0 0 0 6 15 1 0 0 0 0 6 18 1 0 0 0 0 6 19 1 0 0 0 0 7 22 1 0 0 0 0 7 49 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 8 30 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 9 31 1 0 0 0 0 10 12 1 0 0 0 0 10 14 1 0 0 0 0 10 32 1 0 0 0 0 11 16 1 0 0 0 0 11 17 1 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 14 16 2 0 0 0 0 14 36 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 20 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 21 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 25 27 1 0 0 0 0 25 52 1 0 0 0 0 26 28 2 0 0 0 0 26 53 1 0 0 0 0 27 29 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 29 56 1 0 0 0 0 M END $$$$