D0I2GS -OEChem-03141904502D 44 47 0 1 0 0 0 0 0999 V2000 2.0280 0.3046 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 2.3046 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.4921 2.3046 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.2601 -2.2342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.9741 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 6.3046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5289 -6.3046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -0.6954 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 3.3046 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4411 -3.9568 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7199 -5.7168 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2601 -2.2342 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5691 -1.2832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8479 -3.0432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 0.3046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 -1.2832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 2.3046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 3.8046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 0.8046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 0.8046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 1.8046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 1.8046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 4.8046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 3.8046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 5.3046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 4.8046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0289 -4.7658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0289 -4.7658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3379 -5.7168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9786 -2.7866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1355 -1.5353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8791 -0.7462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3619 -3.3899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2786 -2.5972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8382 3.2220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2367 3.9123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 0.4946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8245 -4.0216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2367 4.6970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8382 5.3872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3571 3.4946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3571 5.1146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3933 -4.2642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9276 -5.9084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 21 1 0 0 0 0 3 22 1 0 0 0 0 4 12 1 0 0 0 0 4 16 1 0 0 0 0 5 16 2 0 0 0 0 6 25 2 0 0 0 0 7 11 1 0 0 0 0 7 29 1 0 0 0 0 8 13 1 0 0 0 0 8 15 1 0 0 0 0 8 16 1 0 0 0 0 9 17 1 0 0 0 0 9 18 1 0 0 0 0 9 24 1 0 0 0 0 10 14 1 0 0 0 0 10 27 1 0 0 0 0 10 38 1 0 0 0 0 11 27 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 6 0 0 0 12 30 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 19 1 0 0 0 0 15 20 2 0 0 0 0 17 21 1 0 0 0 0 17 22 2 0 0 0 0 18 23 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 21 2 0 0 0 0 20 22 1 0 0 0 0 20 37 1 0 0 0 0 23 25 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 26 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 26 42 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 43 1 0 0 0 0 29 44 1 0 0 0 0 M END $$$$