D0K0SB -OEChem-04152110592D 71 74 0 1 0 0 0 0 0999 V2000 4.9955 -1.0216 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3224 0.9524 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1877 1.6482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4079 -1.0216 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8428 2.1587 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5982 3.5594 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1376 1.2032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9585 5.0254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7224 -2.7082 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1781 3.4023 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6446 -5.4800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2083 -0.1072 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0027 -2.5014 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7521 -0.4855 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6835 -4.0941 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7926 1.7137 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8911 0.0824 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8023 -0.0404 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8094 0.0790 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3891 -0.8284 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1221 -1.5086 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4824 0.6926 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8679 2.3813 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.4574 0.4701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5731 3.3368 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8029 -3.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0832 -2.8944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2533 4.0699 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3226 0.9673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5230 2.8918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2282 3.8474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7676 1.4912 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.3911 2.2730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9638 -3.8873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3911 2.2730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0146 1.4912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4979 2.6693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7639 -4.4871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7920 0.5162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9901 0.5162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6199 -0.2727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1548 0.5938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2197 -1.4248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6370 -1.8540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8780 0.8306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0506 1.7888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.5547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3904 3.9293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5871 -2.5225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6750 4.5244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3318 1.5873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7026 0.9766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3133 0.3474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6499 4.3018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5628 2.0764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5290 2.8775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8325 2.5420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3566 -0.6234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3304 -0.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1796 -4.4660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3937 -4.1310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9497 2.5420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2531 2.8775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5732 1.2222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4011 1.9759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3709 1.2592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4154 4.1518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9300 -0.0882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4120 0.5162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8911 -0.5376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3802 5.4800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 1 21 1 0 0 0 0 19 2 1 6 0 0 0 2 29 1 0 0 0 0 22 3 1 1 0 0 0 23 3 1 6 0 0 0 20 4 1 6 0 0 0 4 47 1 0 0 0 0 5 23 1 0 0 0 0 5 30 1 0 0 0 0 25 6 1 1 0 0 0 6 67 1 0 0 0 0 7 24 2 0 0 0 0 28 8 1 1 0 0 0 8 71 1 0 0 0 0 9 26 2 0 0 0 0 10 37 2 0 0 0 0 11 38 2 0 0 0 0 12 40 2 0 0 0 0 21 13 1 1 0 0 0 13 26 1 0 0 0 0 13 27 1 0 0 0 0 14 24 1 0 0 0 0 14 58 1 0 0 0 0 14 59 1 0 0 0 0 15 26 1 0 0 0 0 15 38 1 0 0 0 0 15 60 1 0 0 0 0 32 16 1 1 0 0 0 16 37 1 0 0 0 0 16 66 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 70 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 18 41 1 6 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 22 24 1 0 0 0 0 22 45 1 0 0 0 0 23 25 1 0 0 0 0 23 46 1 0 0 0 0 25 28 1 0 0 0 0 25 48 1 0 0 0 0 27 34 2 0 0 0 0 27 49 1 0 0 0 0 28 31 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 30 31 2 0 0 0 0 30 37 1 0 0 0 0 31 54 1 0 0 0 0 32 33 1 0 0 0 0 32 40 1 0 0 0 0 32 55 1 0 0 0 0 33 35 1 0 0 0 0 33 56 1 0 0 0 0 33 57 1 0 0 0 0 34 38 1 0 0 0 0 34 61 1 0 0 0 0 35 36 1 0 0 0 0 35 62 1 0 0 0 0 35 63 1 0 0 0 0 36 39 1 0 0 0 0 36 64 1 0 0 0 0 36 65 1 0 0 0 0 39 68 1 0 0 0 0 39 69 1 0 0 0 0 M END $$$$