B0I2GH -OEChem-04042103033D 52 55 0 1 0 0 0 0 0999 V2000 -6.3933 0.9910 1.1945 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1536 0.3286 -1.3241 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0804 -2.0899 1.6819 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9369 0.9144 0.7847 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4704 -0.9057 0.4199 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1331 0.1525 0.0074 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7261 0.8657 -1.2111 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9158 1.0014 -1.3461 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9105 1.8744 0.3491 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2172 -0.7538 0.5943 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9115 -0.9137 -0.1981 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4841 3.2892 0.0874 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3340 2.9705 1.2823 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9392 -2.0803 0.8538 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0282 -1.8596 -1.3968 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0844 -2.9314 -0.4042 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7373 -3.1714 -1.0718 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1330 0.2163 -0.1008 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1867 -1.3598 0.7246 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9152 1.3161 -0.5143 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5916 -1.2908 1.2732 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7857 -0.0387 -0.7177 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6545 -0.1970 1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2546 -0.1181 -1.1333 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4034 0.6935 -0.1754 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6174 1.5848 0.1502 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1853 1.5119 -1.1575 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9761 -0.3124 1.5726 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6588 0.0850 -0.5721 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9458 3.8396 -0.7244 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4498 3.5601 0.2664 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8670 3.0303 2.2588 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3640 3.3084 1.2695 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4120 -2.6626 1.6171 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9396 -1.8927 1.2637 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5687 -1.3622 -2.2103 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.1068 -1.8016 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5405 -3.8933 -0.1434 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7653 -2.4422 -1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8809 -3.7481 -1.9927 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1053 -3.7806 -0.4143 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8654 0.7379 1.7833 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2316 -1.5348 2.2785 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0143 -2.2086 0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1694 -0.2808 -1.5852 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5401 0.9851 -0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4471 -0.5967 1.9891 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2384 0.6976 1.8275 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4264 0.6026 -1.9415 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4811 -1.1170 -1.5256 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5627 1.9460 0.5291 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7623 1.8212 -2.0185 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 18 2 0 0 0 0 3 19 2 0 0 0 0 4 9 1 0 0 0 0 4 18 1 0 0 0 0 4 42 1 0 0 0 0 5 19 1 0 0 0 0 5 21 1 0 0 0 0 5 22 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 6 25 1 0 0 0 0 7 20 3 0 0 0 0 8 25 2 0 0 0 0 8 27 1 0 0 0 0 9 12 1 0 0 0 0 9 13 1 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 18 1 0 0 0 0 10 28 1 0 0 0 0 11 15 1 0 0 0 0 11 19 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 32 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 17 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 21 23 1 0 0 0 0 21 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 22 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 M END $$$$