D0V9WU -OEChem-09301911233D 53 56 0 0 0 0 0 0 0999 V2000 5.0496 2.0730 1.4472 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3700 0.1236 2.4138 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6007 2.3000 -1.0363 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1234 2.7139 -1.0349 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0676 -1.0133 -0.6239 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4848 0.1586 -0.9044 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0027 -0.8113 -0.7720 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1744 -3.9326 -0.4955 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5928 0.0761 0.3197 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5530 -1.4531 0.4716 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0881 0.4517 0.3051 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8759 -1.7997 1.1403 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8552 -0.8602 0.4608 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8649 0.5369 -0.9413 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9342 0.7240 1.5112 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4448 1.0845 -0.9556 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0675 0.5328 -0.8807 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0399 1.3660 -0.9229 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3128 0.7886 -0.8488 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4209 -0.6128 -0.7344 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2355 -1.3500 -0.7017 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4834 1.5638 -0.8849 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6894 -1.2117 -0.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8415 -0.4266 -0.6964 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7388 0.9580 -0.8091 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2017 -2.7761 -0.5878 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0055 -0.4424 0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6381 -0.0490 1.5068 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3177 -0.2607 -0.2168 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5829 0.5261 2.3569 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2624 0.3143 0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8950 0.7076 1.9199 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5245 -1.9388 -0.5129 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7029 -1.8395 1.0426 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3889 0.9546 -0.6208 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3600 1.1181 1.1325 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1469 -2.8506 1.0043 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7784 -0.7350 1.0341 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1238 -1.2511 -0.5281 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8293 -1.5922 2.2156 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2989 0.0617 -1.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9573 1.6194 -1.0848 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2566 -0.8311 -0.8738 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6250 2.5137 2.2138 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4646 2.6445 -0.9921 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8029 -2.2896 -0.5704 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6208 1.5906 -0.8676 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6358 3.1831 -0.6563 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6288 -0.1991 1.8807 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6091 -0.5651 -1.2183 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2983 0.8279 3.3606 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2841 0.4557 0.2929 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6309 1.1543 2.5821 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 44 1 0 0 0 0 2 15 2 0 0 0 0 3 16 2 0 0 0 0 4 18 1 0 0 0 0 4 48 1 0 0 0 0 5 24 1 0 0 0 0 5 27 1 0 0 0 0 6 14 1 0 0 0 0 6 16 1 0 0 0 0 6 43 1 0 0 0 0 7 17 1 0 0 0 0 7 21 2 0 0 0 0 8 26 3 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 9 15 1 0 0 0 0 10 12 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 13 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 40 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 26 1 0 0 0 0 22 25 2 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 25 47 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 28 30 1 0 0 0 0 28 49 1 0 0 0 0 29 31 2 0 0 0 0 29 50 1 0 0 0 0 30 32 2 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 31 52 1 0 0 0 0 32 53 1 0 0 0 0 M END $$$$