BO4M6D -OEChem-04022102563D 45 46 0 1 0 0 0 0 0999 V2000 2.3530 2.2310 -0.6456 S 0 0 0 0 0 0 0 0 0 0 0 0 5.0080 -2.0185 -1.2442 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1778 -0.7900 2.0484 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4790 -0.3230 -0.3306 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3632 0.6998 0.2279 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7824 0.0165 -0.9058 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7524 -0.9965 -0.2833 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9853 -1.6016 0.8954 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5193 -1.5410 0.4555 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0212 1.4783 -0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5805 0.7042 -0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2829 2.0130 0.2326 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6997 1.8640 0.7731 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5289 0.9109 -0.0895 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9616 0.7944 0.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8321 -0.1673 -0.3792 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2425 -0.3404 0.1891 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0423 -1.3643 -0.6179 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4320 -1.5696 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7342 -0.0888 -1.9975 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7076 -0.5466 0.0055 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2835 -2.6274 1.1336 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2622 -2.3925 -0.1828 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8368 -1.5015 1.3103 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3785 1.5880 0.4969 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7258 1.9681 -1.2092 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4809 -1.6070 -1.9877 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1236 -0.8214 2.2717 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2259 2.7157 0.9046 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3578 2.4358 -0.7775 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6640 1.4867 1.8027 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1788 2.8498 0.8046 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5494 1.2704 -1.1254 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0751 -0.0868 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4309 1.7860 0.4378 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9348 0.4543 1.4778 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8977 0.1938 -1.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3379 -1.1462 -0.4169 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7616 0.6255 0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1773 -0.6674 1.2339 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1319 -1.0301 -1.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5143 -2.3249 -0.6298 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3760 -1.9370 0.9936 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9866 -2.3036 -0.6289 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9995 -0.6335 -0.0367 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 11 1 0 0 0 0 2 7 1 0 0 0 0 2 27 1 0 0 0 0 3 8 1 0 0 0 0 3 28 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 4 11 1 0 0 0 0 5 11 2 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 M END $$$$