LGVM47 -OEChem-05022323072D 43 47 0 0 0 0 0 0 0999 V2000 4.7219 -2.8057 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6678 2.8057 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5783 -0.2521 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2888 -1.6424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2888 0.4269 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5748 -2.4850 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2892 0.9046 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9570 1.6489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3107 1.1108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6464 2.5994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.0614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5998 -0.0459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8890 -1.2026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7968 -1.6077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2212 -1.9469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9320 -0.7902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6628 -1.1077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2426 -1.7407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6937 -2.5965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5288 -1.6077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3949 -1.1077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3949 -0.1077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6628 -0.1077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5288 0.3923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1949 -1.1286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1949 -0.0869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3396 1.1610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5039 1.9410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6968 1.0235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2901 0.4912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2602 2.6868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6669 3.2191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6174 2.5493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4531 1.7694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3253 -0.6623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1552 -3.0105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5288 -2.2277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1259 0.2023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5288 1.0123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4039 -1.7122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8057 -1.0225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8057 -0.1930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4039 0.4968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 19 1 0 0 0 0 2 10 1 0 0 0 0 2 11 1 0 0 0 0 3 12 1 0 0 0 0 3 13 1 0 0 0 0 4 21 1 0 0 0 0 4 25 1 0 0 0 0 5 22 1 0 0 0 0 5 26 1 0 0 0 0 6 18 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 8 10 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 11 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 16 2 0 0 0 0 13 14 1 0 0 0 0 13 15 2 0 0 0 0 14 17 1 0 0 0 0 14 19 2 0 0 0 0 15 18 1 0 0 0 0 16 18 1 0 0 0 0 16 35 1 0 0 0 0 17 20 2 0 0 0 0 17 23 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 22 24 1 0 0 0 0 23 24 2 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 M END $$$$