D06ZYC -OEChem-04152110392D 77 80 0 1 0 0 0 0 0999 V2000 5.5693 0.0504 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.9405 11.2294 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.3674 5.8576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8356 5.2777 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0606 6.8899 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4734 2.9939 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8065 11.7294 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4405 12.0954 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4405 10.3633 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4160 5.4191 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 2.7870 5.7161 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8200 3.5100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6976 2.9110 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1702 1.7868 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6897 6.5929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7140 6.3737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0937 4.6838 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0694 4.9030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4403 5.1999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4250 7.2706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4705 7.5686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7626 5.9353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1093 6.4514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4890 4.7615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7957 3.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1336 6.2322 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.5133 4.5423 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.4559 6.9676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2153 3.5877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5220 2.5554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5066 2.3232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1976 1.3721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2249 1.7868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1976 1.3721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8886 2.3232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8825 0.5874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9030 0.7961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5126 0.5874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8731 2.5554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4921 0.7961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0744 10.7294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6852 6.9930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0991 6.4529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4887 4.5479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0982 4.2837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6843 4.8238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9184 4.8653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6792 4.6278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8452 6.8147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8810 7.6908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0049 7.7265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0754 7.7045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3346 8.1735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8655 7.4327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6312 6.7860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8704 7.0236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5178 4.1422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1039 4.6823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5287 6.0963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9084 4.4064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3998 3.9659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9118 7.3878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0358 7.4235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 6.5474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6235 3.7725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0305 2.9959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8071 3.4030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8309 1.9180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6976 3.5310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6841 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7110 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6884 3.1473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 0.3338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7644 11.2663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5375 10.4194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3844 10.1924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3434 11.4194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 37 1 0 0 0 0 2 7 1 0 0 0 0 2 8 2 0 0 0 0 2 9 2 0 0 0 0 2 41 1 0 0 0 0 3 15 1 0 0 0 0 3 18 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 22 2 0 0 0 0 6 25 2 0 0 0 0 7 77 1 0 0 0 0 10 16 1 0 0 0 0 10 17 1 0 0 0 0 10 19 1 0 0 0 0 11 22 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 12 25 1 0 0 0 0 12 30 1 0 0 0 0 12 61 1 0 0 0 0 13 31 1 0 0 0 0 13 35 1 0 0 0 0 13 69 1 0 0 0 0 14 39 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 15 21 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 1 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 22 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 52 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 23 26 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 24 27 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 26 28 1 6 0 0 0 26 59 1 0 0 0 0 27 29 1 6 0 0 0 27 60 1 0 0 0 0 28 62 1 0 0 0 0 28 63 1 0 0 0 0 28 64 1 0 0 0 0 29 65 1 0 0 0 0 29 66 1 0 0 0 0 29 67 1 0 0 0 0 30 31 1 0 0 0 0 30 33 2 0 0 0 0 31 32 2 0 0 0 0 32 34 1 0 0 0 0 32 36 1 0 0 0 0 33 37 1 0 0 0 0 33 68 1 0 0 0 0 34 35 2 0 0 0 0 34 38 1 0 0 0 0 35 39 1 0 0 0 0 36 37 2 0 0 0 0 36 70 1 0 0 0 0 38 40 2 0 0 0 0 38 71 1 0 0 0 0 39 72 1 0 0 0 0 40 73 1 0 0 0 0 41 74 1 0 0 0 0 41 75 1 0 0 0 0 41 76 1 0 0 0 0 M END $$$$