B2DP6E -OEChem-04012119092D 44 46 0 1 0 0 0 0 0999 V2000 5.2940 0.4091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8864 -1.2185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4750 -0.6170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8060 3.0061 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5426 2.0235 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.2838 1.0576 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.9415 1.5147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6827 0.5488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5094 1.7124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0628 0.1919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2337 0.7511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3060 3.8722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1204 -0.5757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1807 -0.9177 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0070 -1.9025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4146 -0.2749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0673 -2.2446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7731 -2.5453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8937 -3.2294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5994 -3.5301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6597 -3.8722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9119 2.5215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3666 0.4431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5355 1.3369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1365 2.1032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4878 -0.0398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2767 0.3710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5043 2.3324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8950 1.7962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6569 -0.2768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4794 -0.2672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7803 1.1740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8429 4.1822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9960 4.4091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7690 3.5622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2884 -0.3071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8896 0.1236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1046 0.2620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5924 -1.8460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3557 -2.3333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.2184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3111 -3.4414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0744 -3.9287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5521 -4.4827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 13 1 0 0 0 0 2 13 2 0 0 0 0 3 16 1 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 12 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 5 22 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 11 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 36 1 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 19 1 0 0 0 0 17 39 1 0 0 0 0 18 20 2 0 0 0 0 18 40 1 0 0 0 0 19 21 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 M END $$$$