BUA02C -OEChem-04022103573D 46 48 0 0 0 0 0 0 0999 V2000 -3.2265 -0.7817 0.2464 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.3095 -1.8131 -0.2133 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8117 -0.8651 1.5759 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9437 1.7243 0.4490 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4975 -0.6059 -0.8841 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4366 1.2847 -1.3900 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1344 -2.4045 0.1022 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6187 -0.8270 -1.6559 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2389 0.8501 1.0397 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8408 1.2928 1.2304 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 0.1349 0.5744 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4168 2.1659 1.0266 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4264 0.7824 0.1021 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8424 0.8576 -0.2517 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2050 3.1711 0.3449 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1133 -0.4239 0.2258 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3899 0.5626 -0.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9979 -1.1926 -0.5208 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7126 -1.2138 1.3335 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7840 0.2121 -1.2853 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2764 0.4276 -2.0131 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3565 -2.4285 1.2314 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4340 -0.9101 -0.4881 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5155 0.5813 2.0703 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 1.1459 2.2863 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1522 -0.8638 1.0045 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1424 0.0584 -0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4782 2.7035 0.0722 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6455 2.8631 1.8379 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1277 0.9206 -0.9415 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1465 1.5588 0.3747 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7238 3.7262 1.1572 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8337 3.5555 -0.6107 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2789 3.3780 0.4161 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2852 -0.8741 -1.8542 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9768 1.3791 -1.3812 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4627 0.8996 0.2594 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0691 -0.9489 2.1589 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4185 1.1042 -1.2313 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7341 -0.0847 -2.3398 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7361 0.8000 -2.9222 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7203 -3.1625 -0.2192 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3398 -3.3021 1.8678 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4894 -0.6544 0.5749 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4532 -1.0844 -0.8478 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8806 -1.8489 -0.5887 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 5 1 0 0 0 0 1 13 1 0 0 0 0 4 10 1 0 0 0 0 4 14 1 0 0 0 0 4 15 1 0 0 0 0 5 17 1 0 0 0 0 5 35 1 0 0 0 0 6 14 2 0 0 0 0 6 21 1 0 0 0 0 7 18 1 0 0 0 0 7 22 1 0 0 0 0 7 42 1 0 0 0 0 8 18 1 0 0 0 0 8 21 2 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 9 13 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 25 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 28 1 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 14 16 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 17 20 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 19 22 2 0 0 0 0 19 38 1 0 0 0 0 20 23 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 M END $$$$