D04HDZ -OEChem-10101305032D 59 61 0 1 0 0 0 0 0999 V2000 9.9872 1.3827 0.0000 S 0 5 0 0 0 0 0 0 0 0 0 0 6.4759 -0.6711 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.4872 0.5167 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 6.1669 -1.6222 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 9.1212 -2.5221 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6636 -3.3836 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1328 2.1100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1179 -1.9312 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3532 1.0167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4432 -4.4768 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9872 -0.3493 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8578 -2.5732 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 9.6212 0.0167 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2158 -1.3132 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5806 4.1804 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6212 -0.9833 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8121 -1.5711 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.4302 -1.5711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4727 -1.9823 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5772 -2.9768 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.1211 -2.5221 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4945 -1.7744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8611 -1.2621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2192 2.5167 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.3238 3.5112 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9945 -2.6404 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.3019 3.7191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3532 2.0167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8019 2.8531 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4432 -3.4768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7089 -3.3312 0.0000 B 0 0 0 0 0 1 0 0 0 0 0 0 2.0000 -2.7449 0.0000 B 0 0 0 0 0 1 0 0 0 0 0 0 14.7964 2.7486 0.0000 B 0 0 0 0 0 1 0 0 0 0 0 0 9.0687 -0.7018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3737 -2.0095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9966 -1.8233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7402 -1.0341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0515 -2.2045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5447 -3.5960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8397 -3.0746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6861 -1.1847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9281 -1.5222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1521 -0.7146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3725 -0.8804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2517 1.8976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7449 3.2890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0842 0.3267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7723 -3.2192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8683 3.9713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1103 4.3088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0869 -0.7067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1411 2.5993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7426 1.9090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0241 2.2743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0538 -3.5845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6553 -2.8942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7095 4.7868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9910 3.9888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9802 -4.7868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 2 4 2 0 0 0 0 3 9 1 0 0 0 0 3 11 2 0 0 0 0 3 13 1 0 0 0 0 4 8 1 0 0 0 0 4 12 1 0 0 0 0 4 14 1 0 0 0 0 5 17 1 0 0 0 0 5 21 1 0 0 0 0 6 20 1 0 0 0 0 6 26 1 0 0 0 0 7 24 1 0 0 0 0 7 29 1 0 0 0 0 8 23 1 0 0 0 0 9 28 1 0 0 0 0 10 30 1 0 0 0 0 10 59 1 0 0 0 0 13 16 1 0 0 0 0 13 47 1 0 0 0 0 14 19 1 0 0 0 0 14 51 1 0 0 0 0 15 25 1 0 0 0 0 15 57 1 0 0 0 0 15 58 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 34 1 0 0 0 0 17 23 1 0 0 0 0 17 35 1 0 0 0 0 18 21 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 19 38 1 0 0 0 0 20 30 1 0 0 0 0 20 39 1 0 0 0 0 21 31 1 0 0 0 0 21 40 1 0 0 0 0 22 26 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 28 1 0 0 0 0 24 45 1 0 0 0 0 25 27 1 0 0 0 0 25 46 1 0 0 0 0 26 32 1 0 0 0 0 26 48 1 0 0 0 0 27 29 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 33 1 0 0 0 0 29 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 M CHG 2 1 -1 12 -1 M END $$$$