BB45HT -OEChem-04042102413D 68 71 0 1 0 0 0 0 0999 V2000 -6.3720 0.0950 0.9746 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1694 2.5069 0.5514 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0510 -3.4263 0.7555 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5037 -0.2280 -0.2153 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5871 -0.0197 -1.6726 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1875 0.0111 -0.9946 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3482 -2.2380 -0.2238 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8218 -0.7448 1.9399 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0529 1.0107 -0.7739 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4251 -0.3847 -2.6714 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1927 0.5086 -0.0395 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6858 -0.9342 -1.9999 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8067 0.4524 -2.3271 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5295 -0.0885 -0.6104 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0044 0.3399 -1.4453 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5206 0.6207 -1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8707 -0.9085 0.4651 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5998 -0.9044 -1.2354 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5327 1.4808 -0.8391 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7163 -1.0027 -0.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2415 0.1354 0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6574 1.3814 -0.0194 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8531 0.5097 -0.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2032 -1.0194 0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1830 1.5071 -2.4434 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1945 -0.3104 0.1834 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6119 -1.1759 1.5648 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.4020 -2.3875 0.6532 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5835 -0.4268 0.5977 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0320 -1.1569 2.1192 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3090 3.2423 1.4197 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1479 3.9458 2.4653 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1446 -0.8725 2.5083 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7430 0.4812 2.8299 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7903 1.2879 -0.0124 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1981 1.9226 -1.3329 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6866 0.4828 -3.2924 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0342 -1.1608 -3.3406 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6110 1.3353 0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9175 -0.2905 0.6604 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 -1.8964 -1.5182 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4426 -1.1188 -2.7719 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0186 -0.1571 -3.2175 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6898 1.4747 -2.7128 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1130 -1.4782 0.9972 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1973 -1.7921 -1.7177 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0749 2.4507 -1.0188 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6229 1.0667 -1.4211 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4283 -1.6939 1.6829 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0392 2.1174 -2.7511 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3778 2.2007 -2.1787 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8751 0.9089 -3.3068 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9190 -1.2904 2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0429 -3.0308 -0.7803 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7627 -1.0562 1.3086 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1744 -0.2990 2.7852 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2619 -2.0713 2.6751 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5930 2.5777 1.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7544 3.9802 0.8299 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0461 -0.8281 2.5881 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5192 4.5298 3.1432 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7206 3.2195 3.0516 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8735 4.6151 1.9915 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0562 -1.4768 3.4164 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7834 -1.4066 1.7972 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8490 1.0947 1.9292 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1096 1.0316 3.5337 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7333 0.3633 3.2801 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 27 1 0 0 0 0 2 22 1 0 0 0 0 2 31 1 0 0 0 0 3 28 2 0 0 0 0 4 29 2 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 5 13 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 6 14 1 0 0 0 0 7 20 1 0 0 0 0 7 28 1 0 0 0 0 7 54 1 0 0 0 0 8 29 1 0 0 0 0 8 33 1 0 0 0 0 8 60 1 0 0 0 0 9 11 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 12 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 15 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 15 18 2 0 0 0 0 15 19 1 0 0 0 0 16 23 1 0 0 0 0 16 25 1 0 0 0 0 17 24 2 0 0 0 0 17 45 1 0 0 0 0 18 20 1 0 0 0 0 18 46 1 0 0 0 0 19 22 2 0 0 0 0 19 47 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 23 26 2 0 0 0 0 23 48 1 0 0 0 0 24 26 1 0 0 0 0 24 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 30 1 0 0 0 0 27 53 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 31 32 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 32 61 1 0 0 0 0 32 62 1 0 0 0 0 32 63 1 0 0 0 0 33 34 1 0 0 0 0 33 64 1 0 0 0 0 33 65 1 0 0 0 0 34 66 1 0 0 0 0 34 67 1 0 0 0 0 34 68 1 0 0 0 0 M END $$$$