BU8XI5 -OEChem-04022101313D 46 48 0 1 0 0 0 0 0999 V2000 -5.6996 2.9024 0.6421 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6264 -0.7344 -1.9916 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6998 0.1587 0.4579 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2131 -2.3027 2.4947 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7856 -3.7319 1.7257 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7342 -2.4312 -1.7609 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9380 1.0373 -0.5236 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6644 -1.6285 0.1339 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0309 1.6212 -1.3012 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5145 1.8481 0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2037 -0.6651 -0.0963 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6253 -1.9376 -0.7002 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3169 -0.1303 -0.9615 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4553 -2.5348 0.0935 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.1758 2.0280 -0.3844 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7228 2.2513 1.4588 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 -2.9097 1.4996 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6803 -1.6537 -0.8117 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7772 -0.6714 -0.6149 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5948 0.6334 -0.6768 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9179 -0.4226 -1.3423 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8055 0.9546 0.4227 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7853 1.3522 -0.8819 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1186 1.9515 1.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1268 2.3616 0.0288 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3068 2.6536 1.1217 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3846 0.9262 -2.0687 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6175 2.5029 -1.8049 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0313 2.7397 0.2061 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7849 1.3342 1.2504 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4238 0.1002 -0.0217 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6063 -0.8685 0.9015 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4190 -2.6925 -0.7808 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2857 -1.7359 -1.7252 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1225 -3.4624 -0.3876 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6494 1.1532 0.0769 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9420 2.5631 -0.9538 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4200 2.9517 2.2434 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1803 1.3809 1.9442 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7062 -0.9436 0.8838 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2285 -0.9356 -2.2419 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4326 1.1363 -1.7266 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4775 2.1724 2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5182 -2.5906 3.3814 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0447 2.9251 -0.1186 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5975 3.4419 1.8118 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 13 2 0 0 0 0 3 19 1 0 0 0 0 3 22 1 0 0 0 0 4 17 1 0 0 0 0 4 44 1 0 0 0 0 5 17 2 0 0 0 0 6 18 2 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 7 13 1 0 0 0 0 8 14 1 0 0 0 0 8 18 1 0 0 0 0 8 40 1 0 0 0 0 9 15 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 16 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 14 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 14 17 1 0 0 0 0 14 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 18 19 1 0 0 0 0 19 21 2 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 2 0 0 0 0 21 41 1 0 0 0 0 22 24 2 0 0 0 0 23 25 1 0 0 0 0 23 42 1 0 0 0 0 24 26 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 M END $$$$