BATS20 -OEChem-04012114342D 70 74 0 1 0 0 0 0 0999 V2000 2.6166 2.1879 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7976 0.4653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1880 1.6925 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 10.7347 2.8949 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.4947 2.8602 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8398 -3.7218 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6488 -4.3096 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2706 2.8949 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1661 1.9004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3571 3.3016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6880 2.5585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1367 3.3949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7812 0.7789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7867 0.6744 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.0027 2.8949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1989 1.4834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3800 -0.2391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8687 3.3949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9677 -1.0482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3854 -0.3437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8687 4.3949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2044 1.3789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6008 3.3949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6008 4.3949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7347 4.8949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4947 4.9296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5610 -1.9617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4008 4.4157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9787 -1.2572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4008 3.3741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5665 -2.0662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1488 -2.7707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1488 -2.7707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4578 -3.7218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4089 -4.0308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7906 2.5572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2309 1.2838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7861 1.9004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6671 3.8386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8555 3.6661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2731 3.0192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1864 2.1941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5352 3.8698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7381 3.8698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7380 0.1604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3828 0.6289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0389 1.2408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6042 2.4200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4012 2.4200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7562 1.7552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0280 2.0794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5844 -0.9834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0210 0.1579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3318 4.7049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7347 5.5149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8883 5.4086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0901 5.3994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0116 4.3096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6098 4.9994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3621 -1.3220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6098 2.7904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0116 3.4802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4875 2.2403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3143 -2.6326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.1231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5132 -2.2691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6488 -4.9296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2173 -4.6204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9985 -4.2224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6005 -3.4411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 65 1 0 0 0 0 2 22 2 0 0 0 0 3 9 1 0 0 0 0 3 11 1 0 0 0 0 3 13 1 0 0 0 0 4 18 2 0 0 0 0 4 23 1 0 0 0 0 5 23 1 0 0 0 0 5 30 1 0 0 0 0 5 63 1 0 0 0 0 6 7 1 0 0 0 0 6 32 2 0 0 0 0 7 34 1 0 0 0 0 7 67 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 1 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 15 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 16 1 6 0 0 0 14 17 1 0 0 0 0 14 47 1 0 0 0 0 15 18 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 22 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 17 19 1 0 0 0 0 17 20 2 0 0 0 0 18 21 1 0 0 0 0 19 27 2 0 0 0 0 19 52 1 0 0 0 0 20 29 1 0 0 0 0 20 53 1 0 0 0 0 21 25 2 0 0 0 0 21 54 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 55 1 0 0 0 0 26 28 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 27 31 1 0 0 0 0 27 32 1 0 0 0 0 28 30 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 29 31 2 0 0 0 0 29 60 1 0 0 0 0 30 61 1 0 0 0 0 30 62 1 0 0 0 0 31 64 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 33 66 1 0 0 0 0 34 35 1 0 0 0 0 35 68 1 0 0 0 0 35 69 1 0 0 0 0 35 70 1 0 0 0 0 M END $$$$