IBS-ZINC05322001 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6070 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -1.9920 -1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 -2.6020 -2.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 -1.8350 -3.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -0.4550 -3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 0.1610 -2.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 -2.5030 -4.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4900 -2.7390 -5.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 -3.8740 -5.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 -4.0510 -6.4550 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 -3.1620 -7.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4190 -2.0720 -7.4680 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3320 -1.8240 -6.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 -0.7140 -6.5540 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8000 -4.7800 -4.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -2.5910 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -3.6800 -2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 0.1420 -3.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 1.2380 -2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 -1.8620 -4.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9250 -3.4570 -4.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 -3.3320 -8.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7740 -4.8400 -6.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 -1.4410 -8.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 1 0 0 0 0 11 17 2 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END