D04JCN -OEChem-10121500282D 48 51 0 1 0 0 0 0 0999 V2000 2.8680 2.8736 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.5399 1.3700 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.5279 -2.8202 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6578 -0.1715 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5238 0.3285 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7478 0.3353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7398 1.3769 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6418 1.8978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3898 -0.1715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6578 -1.1715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3898 -1.1715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5238 -1.6715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4116 1.8600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8718 1.8736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5399 -2.7130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7478 -1.6784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0078 -1.9499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4232 2.8599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6418 -3.2408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7398 -2.7200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2949 3.3498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.3702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9250 -0.6022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2632 0.7478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1361 0.4367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5432 -0.2499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7386 1.9969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0428 2.3706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2445 2.3737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0004 -0.2792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6019 0.4111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6169 1.2749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0234 1.9606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2608 1.9789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6620 1.2902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2145 -1.3622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6256 -1.8981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2179 3.4449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8114 2.7593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8139 -3.3702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6442 -3.8608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2016 -3.0279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5987 2.8094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8354 3.6536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9912 3.8903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3079 3.9084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4619 3.6782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6921 2.8321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 22 1 0 0 0 0 2 5 1 0 0 0 0 2 8 1 0 0 0 0 2 13 1 0 0 0 0 3 15 1 0 0 0 0 3 17 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 4 23 1 6 0 0 0 5 9 1 0 0 0 0 5 24 1 1 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 1 0 0 0 7 27 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 11 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 12 2 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 17 2 0 0 0 0 12 15 1 0 0 0 0 13 18 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 19 2 0 0 0 0 16 20 2 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 18 21 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 M END $$$$