LL6T5R -OEChem-05032301513D 31 32 0 0 0 0 0 0 0999 V2000 -4.1083 -1.7256 1.5794 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 2.5742 0.2335 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3784 -0.9165 -1.0936 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8465 3.4747 -0.5699 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 2.7710 1.6677 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9939 -2.6853 1.9251 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5411 2.4759 -0.4448 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6046 0.3527 1.7896 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2767 -3.3618 -0.2477 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6859 -2.2388 -2.1533 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6596 0.9405 -0.0513 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9087 0.3468 -1.2668 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9981 -0.0196 0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4299 -1.1316 0.2471 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4113 1.4329 -0.0141 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7700 0.7979 -2.6596 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9132 0.4998 -0.9148 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8945 -2.3974 0.7023 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7841 1.3169 1.3154 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7598 -0.5071 -0.4645 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0721 -0.5367 0.8851 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2709 -1.4630 -1.3966 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9345 0.0849 2.0061 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5797 2.6416 -1.4598 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4031 1.6708 -2.8456 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7343 1.0716 -2.8792 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0648 0.0145 -3.3652 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6425 0.5611 -1.9667 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4530 2.0224 2.0696 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2248 -3.1821 -1.2454 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6182 -4.2721 0.0422 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 2 4 2 0 0 0 0 2 5 2 0 0 0 0 2 7 1 0 0 0 0 2 11 1 0 0 0 0 3 12 1 0 0 0 0 3 14 1 0 0 0 0 6 18 2 0 0 0 0 7 15 1 0 0 0 0 7 24 1 0 0 0 0 8 19 2 0 0 0 0 8 21 1 0 0 0 0 9 18 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 22 3 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 13 23 1 0 0 0 0 14 18 1 0 0 0 0 15 17 2 0 0 0 0 15 19 1 0 0 0 0 16 25 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 17 20 1 0 0 0 0 17 28 1 0 0 0 0 19 29 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M END $$$$