D0X9TF -OEChem-10101305022D 78 81 0 1 0 0 0 0 0999 V2000 12.1827 -0.3994 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5586 -1.7700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8224 1.3392 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 7.4218 -0.9054 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 10.2313 2.4627 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0130 -2.0288 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.7974 1.5618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4469 -1.1279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4469 -2.9298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7974 3.3637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5999 0.3643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6444 0.0696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8224 3.5862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4218 -3.1523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2037 -1.5288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0406 1.9627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1322 2.8966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1120 -1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0406 2.9627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2037 -2.5288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1322 2.0288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1120 -2.4627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0373 -0.5978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2070 3.8938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2858 -1.8994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2070 1.0316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9585 2.5922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0373 -3.4599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1079 0.5978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3848 -2.3333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8594 2.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1364 -3.8938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9342 1.1611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3101 -3.3305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7974 0.9418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4018 1.4238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4469 -0.5079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8424 -0.9899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4018 3.5017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7974 3.9837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8424 -3.0678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4469 -3.5498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6770 -0.2509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2192 0.3334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5673 0.6848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0251 0.1005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0914 4.1448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3377 3.9728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1528 -3.7109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9066 -3.5389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4362 2.1007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7716 1.4041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8081 -1.6668 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4727 -0.9703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3001 2.2998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7491 2.9583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4951 -1.5332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9441 -2.1918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7716 3.5213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4362 2.8248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4727 -3.0874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8081 -2.3909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6556 -0.5514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9910 0.0205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4191 -0.6441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8252 3.8475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2533 4.5121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5887 3.9402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3321 -1.2812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6947 0.6824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5496 -3.8092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9121 3.2104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3717 2.5076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0900 -4.5121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7515 -3.5995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4928 0.8921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7413 -0.6684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.0390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 1 77 1 0 0 0 0 2 30 1 0 0 0 0 2 78 1 0 0 0 0 3 7 1 0 0 0 0 3 11 1 0 0 0 0 3 16 1 0 0 0 0 4 8 1 0 0 0 0 4 12 1 0 0 0 0 4 15 1 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 5 17 1 6 0 0 0 5 21 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 18 1 6 0 0 0 6 22 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 14 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 13 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 45 1 0 0 0 0 12 46 1 0 0 0 0 13 19 1 0 0 0 0 13 47 1 0 0 0 0 13 48 1 0 0 0 0 14 20 1 0 0 0 0 14 49 1 0 0 0 0 14 50 1 0 0 0 0 15 20 1 0 0 0 0 15 53 1 0 0 0 0 15 54 1 0 0 0 0 16 19 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 24 1 0 0 0 0 17 55 1 0 0 0 0 17 56 1 0 0 0 0 18 23 1 0 0 0 0 18 57 1 0 0 0 0 18 58 1 0 0 0 0 19 59 1 0 0 0 0 19 60 1 0 0 0 0 20 61 1 0 0 0 0 20 62 1 0 0 0 0 21 26 2 0 0 0 0 21 27 1 0 0 0 0 22 25 2 0 0 0 0 22 28 1 0 0 0 0 23 63 1 0 0 0 0 23 64 1 0 0 0 0 23 65 1 0 0 0 0 24 66 1 0 0 0 0 24 67 1 0 0 0 0 24 68 1 0 0 0 0 25 30 1 0 0 0 0 25 69 1 0 0 0 0 26 29 1 0 0 0 0 26 70 1 0 0 0 0 27 31 2 0 0 0 0 27 72 1 0 0 0 0 28 32 2 0 0 0 0 28 71 1 0 0 0 0 29 33 2 0 0 0 0 30 34 2 0 0 0 0 31 33 1 0 0 0 0 31 73 1 0 0 0 0 32 34 1 0 0 0 0 32 74 1 0 0 0 0 33 76 1 0 0 0 0 34 75 1 0 0 0 0 M END $$$$