B5ZOG9 -OEChem-04012115082D 66 72 0 1 0 0 0 0 0999 V2000 4.0364 3.5536 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.5761 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7250 3.4073 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9568 -2.7952 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1433 -3.5243 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0095 2.9464 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7435 2.0464 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7431 -0.7111 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1435 1.4464 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2775 1.9464 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5405 1.2794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9456 0.3716 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1435 3.4464 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9343 0.4746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2775 2.9464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0095 1.9464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3527 4.4183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7435 2.8464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8700 2.0214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5458 1.3822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3523 -0.5420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 0.2670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3414 4.5213 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7466 3.6135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6092 -1.2111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3478 -0.8485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8414 5.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8100 -2.2332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5722 -1.8657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7981 -2.5627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6090 -4.3950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8615 -3.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5954 -4.5230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7329 -5.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4621 -4.9168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5414 2.3714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9334 -0.1454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5508 0.4086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0654 3.5291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6669 2.8388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2216 1.3638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6201 2.0541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5830 1.4476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3536 5.0383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7362 4.4843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3301 2.4370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4544 2.4814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 1.6057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6095 1.9989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9291 1.4460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4820 0.7655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9606 4.4891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1768 -0.9633 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8037 -0.4284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3784 5.0774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1514 5.9243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3045 5.6974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1626 -2.0550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2800 -4.0273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3993 -5.1112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1177 -5.4642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8098 -6.0026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3482 -5.3105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1386 -5.4458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9910 -5.2404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7856 -4.3880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 2 0 0 0 0 2 22 2 0 0 0 0 3 24 2 0 0 0 0 4 28 1 0 0 0 0 4 32 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 13 1 0 0 0 0 6 16 1 0 0 0 0 6 24 1 0 0 0 0 7 9 1 0 0 0 0 7 18 1 0 0 0 0 7 43 1 0 0 0 0 8 22 1 0 0 0 0 8 25 1 0 0 0 0 8 53 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 1 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 36 1 1 0 0 0 11 12 1 0 0 0 0 11 19 1 0 0 0 0 11 20 1 0 0 0 0 12 14 1 0 0 0 0 12 21 1 0 0 0 0 12 22 1 1 0 0 0 13 15 1 0 0 0 0 13 17 1 1 0 0 0 13 18 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 23 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 25 2 0 0 0 0 21 26 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 1 0 0 0 23 52 1 0 0 0 0 25 28 1 0 0 0 0 26 29 2 0 0 0 0 26 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 28 30 2 0 0 0 0 29 30 1 0 0 0 0 29 58 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 31 35 1 0 0 0 0 32 33 2 0 0 0 0 32 59 1 0 0 0 0 33 60 1 0 0 0 0 34 61 1 0 0 0 0 34 62 1 0 0 0 0 34 63 1 0 0 0 0 35 64 1 0 0 0 0 35 65 1 0 0 0 0 35 66 1 0 0 0 0 M END $$$$