IFLAB-ZINC04119737 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 0 0 0 0 0 0 0 0999 V2000 -6.2920 -2.1240 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6740 -2.9350 0.0040 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.6230 -1.5210 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0750 -0.3100 -0.0690 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9600 0.6450 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7010 -0.2440 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2520 -1.6100 -0.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 -2.7500 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 -3.8190 0.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -2.7000 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -3.8810 -0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 -3.8280 -0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6960 -2.6070 -0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9750 -1.4320 -0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -1.4710 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1700 -2.5570 -0.4960 N 0 3 0 0 0 0 0 0 0 0 0 0 4.8070 -3.5890 -0.6050 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7460 -1.4840 -0.4910 O 0 5 0 0 0 0 0 0 0 0 0 0 -7.0770 -2.8800 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3810 -1.4790 0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3920 -1.5260 -0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9950 1.2420 -1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9830 1.2890 0.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 -0.0940 -0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1010 -0.0460 0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -4.8350 -0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6140 -4.7410 -0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4890 -0.4820 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -0.5530 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 6 25 1 0 0 0 0 7 8 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 15 2 0 0 0 0 11 12 2 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END