B3IVR7 -OEChem-04012118422D 45 48 0 1 0 0 0 0 0999 V2000 6.1381 3.2846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4060 3.2780 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -1.2880 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5298 -1.2880 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5298 -0.2880 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3958 -1.7880 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5836 -1.5927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 0.2120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5836 0.0168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -0.2880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.7880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 -2.7880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3798 1.2536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1719 0.2189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2778 1.7813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5298 -3.2880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -3.2880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1799 1.2605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5298 -4.2880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -4.2880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2740 2.7813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 -4.7880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1342 4.2846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9983 4.7880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4399 -2.1332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4399 0.5573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9328 -2.0980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0462 -1.9019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8346 -2.1596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 0.6061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7988 -1.5980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -0.7880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8393 1.5573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7052 -0.0973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9929 -2.9780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7988 -2.9780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7180 1.5684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9929 -4.5980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7988 -4.5980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 -5.4080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9199 4.8664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5240 4.1746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3104 4.2522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5340 5.1000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6862 5.3237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 23 1 0 0 0 0 2 21 2 0 0 0 0 3 6 1 0 0 0 0 3 10 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 4 25 1 6 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 5 26 1 1 0 0 0 6 12 1 6 0 0 0 6 27 1 0 0 0 0 7 11 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 10 2 0 0 0 0 8 13 1 0 0 0 0 9 11 2 0 0 0 0 9 30 1 0 0 0 0 10 14 1 0 0 0 0 11 32 1 0 0 0 0 12 16 2 0 0 0 0 12 17 1 0 0 0 0 13 15 2 0 0 0 0 13 33 1 0 0 0 0 14 18 2 0 0 0 0 14 34 1 0 0 0 0 15 18 1 0 0 0 0 15 21 1 0 0 0 0 16 19 1 0 0 0 0 16 35 1 0 0 0 0 17 20 2 0 0 0 0 17 36 1 0 0 0 0 18 37 1 0 0 0 0 19 22 2 0 0 0 0 19 38 1 0 0 0 0 20 22 1 0 0 0 0 20 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 23 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 M END $$$$