D03CKG -OEChem-04152122353D 30 31 0 0 0 0 0 0 0999 V2000 -3.6161 0.2495 0.0795 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.0695 0.2759 -1.4911 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1164 -0.9952 0.6447 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9708 1.5291 0.6734 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1464 1.1138 -0.0163 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 0.0355 0.0116 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1693 -1.1560 0.0185 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3347 -0.0473 -0.0087 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2325 -1.0729 0.0386 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8723 0.1670 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2724 1.2749 0.0247 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 -2.3952 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9745 -1.2871 -0.0216 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1212 1.3387 0.0448 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2235 -2.4588 -0.0148 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5459 1.7141 -1.2699 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5693 1.7141 1.2297 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8193 -1.9894 0.0365 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8178 2.2154 0.0201 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2634 -3.3241 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0598 -1.3520 -0.0371 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5974 2.3151 0.0473 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7220 -3.4237 -0.0249 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6917 2.1929 -1.7596 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9547 0.9594 -1.9508 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3206 2.4751 -1.1276 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3759 1.1255 1.6791 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7421 1.7666 1.9461 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9372 2.7354 1.0843 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8197 -0.5203 -2.0166 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 10 1 0 0 0 0 2 30 1 0 0 0 0 5 8 1 0 0 0 0 5 16 1 0 0 0 0 5 17 1 0 0 0 0 6 7 2 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 12 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 18 1 0 0 0 0 10 14 1 0 0 0 0 11 14 2 0 0 0 0 11 19 1 0 0 0 0 12 15 2 0 0 0 0 12 20 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 14 22 1 0 0 0 0 15 23 1 0 0 0 0 16 24 1 0 0 0 0 16 25 1 0 0 0 0 16 26 1 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 17 29 1 0 0 0 0 M END $$$$