D0X2HT -OEChem-04152111193D 55 59 0 1 0 0 0 0 0999 V2000 2.4722 2.8481 0.2062 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5889 0.3847 1.0093 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4607 2.0598 -0.8156 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0383 -2.1224 0.8093 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8339 4.1449 0.4265 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7241 2.9189 -0.5459 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5353 1.9939 1.3913 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7031 -1.3937 -1.3094 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6191 0.1215 0.4881 N 0 3 2 0 0 0 0 0 0 0 0 0 -1.7723 0.6823 0.4814 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.6806 1.1156 -0.6800 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.7989 0.0429 -0.8109 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.4060 1.3969 0.6255 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.5688 0.6696 1.8029 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 -0.6853 0.1857 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8388 -0.1805 1.7444 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2767 -1.4010 -1.0734 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9288 -1.6965 -0.4712 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0521 2.1735 -0.6359 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.8975 1.3372 -1.9486 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0678 -0.7997 0.5641 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 1.8021 -1.9194 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9220 -0.6312 0.4351 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2605 -2.9117 -0.6313 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7454 -1.9908 0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -3.0609 -0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9813 -1.7857 -0.1835 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3918 -1.9681 0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3437 -2.3866 -0.7654 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8603 -0.6778 1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1509 2.0807 -0.4415 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4993 0.3269 -1.6062 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4356 2.1108 1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8501 1.7017 2.0519 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9491 0.3119 2.6355 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8989 1.1087 0.5679 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6212 -1.2532 1.7572 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4891 0.0512 2.5949 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1647 -1.5107 -2.1605 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9956 -2.1610 -0.7547 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2036 3.2321 -0.4957 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3791 1.1549 -2.9043 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1265 1.9923 -2.8576 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7225 -1.7032 0.4889 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5236 -0.3136 1.2911 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4330 -0.3678 -0.4943 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7445 -3.7424 -1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5654 -4.0147 -0.3082 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3726 -2.7764 1.0933 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4266 -1.6098 -1.5336 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3460 -2.5817 -0.3701 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9881 -3.2992 -1.2561 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8725 0.1535 0.3007 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8689 -0.7920 1.4243 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1911 -0.3977 1.8345 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 1 5 1 0 0 0 0 1 6 2 0 0 0 0 1 7 2 0 0 0 0 2 13 1 0 0 0 0 2 21 1 0 0 0 0 3 19 1 0 0 0 0 4 25 1 0 0 0 0 4 27 1 0 0 0 0 8 27 2 0 0 0 0 9 12 1 0 0 0 0 9 16 1 0 0 0 0 9 23 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 10 14 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 11 31 1 0 0 0 0 12 17 1 0 0 0 0 12 32 1 0 0 0 0 13 19 1 0 0 0 0 13 33 1 0 0 0 0 14 16 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 18 2 0 0 0 0 15 21 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 24 1 0 0 0 0 19 22 1 0 0 0 0 19 41 1 0 0 0 0 20 22 2 0 0 0 0 20 42 1 0 0 0 0 21 25 2 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 26 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 M CHG 2 5 -1 9 1 M END $$$$