B8GW2H -OEChem-04012117272D 52 55 0 0 0 0 0 0 0999 V2000 5.6104 3.2710 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.3900 0.1778 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5239 -4.3222 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0598 -4.3222 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7919 -5.3222 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3644 4.6142 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7657 5.6322 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5239 1.6778 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3900 3.1778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3900 2.1778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5239 3.6778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7919 -1.3222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6579 0.1778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7919 -2.3222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6579 -0.8222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9413 4.0142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5239 0.6778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2560 3.6778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4194 4.6723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2560 1.6778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9259 -0.8222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4413 4.8802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7919 0.6778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9259 0.1778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9259 -2.8222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6579 -2.8222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9467 3.9097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1220 3.1778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1220 2.1778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6579 -3.8222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9259 -3.8222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7919 -4.3222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3590 4.7187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1948 -1.1322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9870 1.9878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2560 4.2978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8802 5.0872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2560 1.0578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3889 -1.1322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1891 5.4466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7919 1.2978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3889 -2.5122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1948 -2.5122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3889 0.4878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3895 3.6379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1176 3.3137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6589 3.4878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6589 1.8678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0609 -4.0122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5229 -4.0122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2550 -5.6322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 5.1157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 16 1 0 0 0 0 2 17 2 0 0 0 0 3 30 1 0 0 0 0 3 49 1 0 0 0 0 4 31 1 0 0 0 0 4 50 1 0 0 0 0 5 32 1 0 0 0 0 5 51 1 0 0 0 0 6 33 1 0 0 0 0 6 52 1 0 0 0 0 7 33 2 0 0 0 0 8 10 1 0 0 0 0 8 17 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 18 2 0 0 0 0 10 20 2 0 0 0 0 11 19 2 0 0 0 0 12 14 1 0 0 0 0 12 15 2 0 0 0 0 12 21 1 0 0 0 0 13 15 1 0 0 0 0 13 17 1 0 0 0 0 13 23 2 0 0 0 0 14 25 2 0 0 0 0 14 26 1 0 0 0 0 15 34 1 0 0 0 0 16 22 2 0 0 0 0 16 27 1 0 0 0 0 18 28 1 0 0 0 0 18 36 1 0 0 0 0 19 22 1 0 0 0 0 19 37 1 0 0 0 0 20 29 1 0 0 0 0 20 38 1 0 0 0 0 21 24 2 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 44 1 0 0 0 0 25 31 1 0 0 0 0 25 42 1 0 0 0 0 26 30 2 0 0 0 0 26 43 1 0 0 0 0 27 33 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 29 2 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 30 32 1 0 0 0 0 31 32 2 0 0 0 0 M END $$$$