D07JOR -OEChem-09301911193D 54 57 0 1 0 0 0 0 0999 V2000 -11.1203 -0.1954 -0.4108 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.6300 1.5944 -0.2124 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1053 -2.6930 0.1435 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7210 -0.5181 0.3353 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5349 0.3498 -0.0996 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5798 0.5681 -0.0480 N 0 0 2 0 0 0 0 0 0 0 0 0 5.3209 2.0192 0.1333 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6368 -0.2787 0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9380 2.4385 -0.4249 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2421 0.1563 0.4524 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9590 0.2448 0.3178 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9573 1.4032 -0.0499 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4442 -1.0473 -0.3595 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9908 -0.4764 0.6245 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0428 0.4366 0.2064 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3900 -0.9608 -1.8837 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3909 0.4137 0.1267 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8701 -1.3569 0.0696 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0805 1.5272 -0.3533 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 -0.7215 0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4731 1.5053 -0.4303 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4865 -0.7435 0.4531 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1761 0.3700 -0.0272 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1904 -0.8419 0.3321 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6708 -0.6816 0.1464 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4492 -0.1526 1.1761 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2685 -1.0609 -1.0554 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8252 -0.0034 1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6446 -0.9117 -1.2275 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4230 -0.3829 -0.1979 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3841 2.2779 1.1992 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0795 2.6145 -0.3898 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8272 -0.1968 1.8067 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7386 -1.3297 0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9858 2.5118 -1.5174 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6525 3.4176 -0.0275 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6263 1.0536 -0.0116 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0861 0.1856 1.4073 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8241 -1.8868 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8119 -1.4711 1.0078 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9762 -0.1121 -2.2534 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3621 -0.8516 -2.2435 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8058 -1.8665 -2.3391 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5697 2.4304 -0.6768 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5849 -1.6039 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0054 2.3755 -0.8046 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9657 -1.6574 0.7863 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0243 -2.8871 0.4264 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9888 -1.0342 1.3943 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8620 -1.7063 -0.2603 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9949 0.1491 2.1162 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6727 -1.4718 -1.8661 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4191 0.4110 1.8146 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0967 -1.2107 -2.1697 H 0 0 0 0 0 0 0 0 0 0 0 0 1 30 1 0 0 0 0 2 12 1 0 0 0 0 2 15 1 0 0 0 0 3 18 1 0 0 0 0 3 48 1 0 0 0 0 4 18 2 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 7 9 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 10 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 12 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 12 2 0 0 0 0 10 14 1 0 0 0 0 11 13 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 13 16 1 0 0 0 0 13 18 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 19 21 1 0 0 0 0 19 44 1 0 0 0 0 20 22 2 0 0 0 0 20 45 1 0 0 0 0 21 23 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 26 28 1 0 0 0 0 26 51 1 0 0 0 0 27 29 2 0 0 0 0 27 52 1 0 0 0 0 28 30 2 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 M END $$$$