MMs01680402 MOE2007 2D Structure written by MMmdl. 40 42 0 0 1 0 0 0 0 0999 V2000 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7421 1.3035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2421 1.3126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9999 0.0181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2578 -1.2854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7578 -1.2945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 0.0272 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2577 -1.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5156 -2.5709 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7577 -1.2583 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7862 -0.1202 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.2105 0.3041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0305 -0.5126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9415 -1.3761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5183 -1.1429 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.1183 -2.1822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6274 1.2531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5432 -2.1067 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.5040 -2.7067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5104 -3.6063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7927 -4.3845 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9239 0.7658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9146 -0.7769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3879 1.7072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9434 2.4865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0266 2.4931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3673 1.7298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5999 1.0573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3879 -1.6890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0566 -2.4684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3673 -1.7117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9733 -2.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0936 1.0700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9903 0.0860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1164 -0.0020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0018 -0.8142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1356 -2.5603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4914 1.6399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4641 2.1133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1952 -4.3277 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 M CHG 1 40 -1 M END