L2RM4A -OEChem-05022322493D 40 41 0 1 0 0 0 0 0999 V2000 -3.0220 -1.0816 -0.5527 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6928 0.3695 -1.8589 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1675 -0.6645 -1.9415 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5118 -2.3923 -0.1473 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8834 1.2040 0.1855 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7369 0.1021 0.4513 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8233 -0.7294 0.9896 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3011 0.6657 1.3941 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7442 -1.1008 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3564 -0.8184 0.6018 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1647 0.2287 -0.7657 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8589 -0.0250 -0.4321 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5075 -1.6933 1.2798 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2187 2.6067 0.0698 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 -0.9816 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4873 -0.1066 -0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8386 -1.7749 0.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3118 1.5053 0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4606 2.4364 0.7147 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6784 2.2501 -0.1793 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9949 -1.4228 1.8227 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4985 1.3159 1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0965 0.6112 2.1455 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2648 -1.7249 -0.9415 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6487 -1.6012 0.1818 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4877 0.6690 -0.9791 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8793 -2.3166 2.0885 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3103 3.1994 0.2058 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6489 2.8157 -0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9456 2.8598 0.8463 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8538 0.5231 -1.5938 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4828 -2.4575 1.4709 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0903 -0.1927 1.3702 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4739 1.6741 1.0312 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9782 1.7325 -0.6706 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7575 2.2669 1.7567 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1166 3.4746 0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4496 2.9825 0.0801 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1150 1.2532 -0.0643 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4166 2.3931 -1.2326 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 6 1 0 0 0 0 1 15 1 0 0 0 0 2 11 2 0 0 0 0 5 8 1 0 0 0 0 5 11 1 0 0 0 0 5 14 1 0 0 0 0 6 18 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 7 21 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 12 16 1 0 0 0 0 12 26 1 0 0 0 0 13 17 2 0 0 0 0 13 27 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 31 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 M END $$$$