B0RXT2 -OEChem-04012115342D 48 49 0 1 0 0 0 0 0999 V2000 6.6648 2.0361 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 4.0361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 3.0361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.5361 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3919 0.2809 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.5361 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2690 3.0361 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4030 2.5361 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2690 1.0361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.5361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0812 2.8408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0812 1.2314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3704 0.0746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6811 -0.8759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6596 -1.0821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9702 -2.0326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9487 -2.2388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2594 -3.1894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2379 -3.3956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5486 -4.3461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2250 3.3813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8059 3.3461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 3.1561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8705 0.5612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6675 0.5612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7924 1.6438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1909 0.9535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6186 3.1501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8302 3.4077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.3461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.7261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9842 0.1620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3910 0.6943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0672 -0.9632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6605 -1.4956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2734 -0.9948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6801 -0.4624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3564 -2.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9497 -2.6523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5626 -2.1515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9693 -1.6192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6456 -3.2767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2388 -3.8090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8517 -3.3082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2585 -2.7759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9592 -4.5387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7412 -4.9354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1379 -4.1535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 7 2 1 6 0 0 0 2 30 1 0 0 0 0 8 3 1 1 0 0 0 3 31 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 4 12 1 0 0 0 0 5 12 2 0 0 0 0 5 13 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 6 21 1 6 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 M END $$$$