LDCS37 -OEChem-05022322512D 40 41 0 0 0 0 0 0 0999 V2000 5.4921 4.0189 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -1.4811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4921 4.0189 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4921 4.0189 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -2.9811 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4921 0.0189 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5691 -3.5689 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4921 5.0189 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 -1.4811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 -0.4811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -1.9811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 -3.5689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4921 1.0189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2601 -4.5199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2601 -4.5199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4921 3.0189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 1.5189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3582 1.5189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6261 2.5189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3582 2.5189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.2598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8479 -5.3289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8382 -2.0637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2367 -1.3734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4140 0.1015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0155 -0.5887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0291 -0.2911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8956 -5.0215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0892 1.2089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8951 1.2089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0892 2.8289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8951 2.8289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1916 -2.6702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4103 -3.0682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8084 -3.8495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3463 -5.6934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2123 -5.8305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3494 -4.9645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0291 5.3289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9552 5.3289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 8 1 0 0 0 0 1 16 1 0 0 0 0 2 11 2 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 6 10 1 0 0 0 0 6 13 1 0 0 0 0 6 27 1 0 0 0 0 7 15 2 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 11 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 14 2 0 0 0 0 12 21 1 0 0 0 0 13 17 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 22 1 0 0 0 0 16 19 2 0 0 0 0 16 20 1 0 0 0 0 17 19 1 0 0 0 0 17 29 1 0 0 0 0 18 20 2 0 0 0 0 18 30 1 0 0 0 0 19 31 1 0 0 0 0 20 32 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 M END $$$$