IBS-ZINC04863182 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 0.5890 1.2160 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -0.2820 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 -2.0600 0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8920 -2.3430 0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2830 -0.5710 -1.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 -0.2320 -1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9920 -2.2880 -0.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6500 -2.3100 -2.3140 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6510 -1.3030 -2.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0650 -2.8040 -2.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5140 -4.0800 -2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8700 -4.1150 -2.3720 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.4580 -4.9240 -2.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3270 -2.8840 -1.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2200 -2.0390 -1.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4280 -0.7000 -1.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7210 -0.2500 -1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8010 -1.1260 -1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6240 -2.4590 -1.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7860 1.0680 -0.8090 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.0750 1.5930 -0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8350 -3.1210 -3.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6550 1.4200 0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 1.7220 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 1.6630 0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 -0.7280 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 -0.7560 0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 -2.2570 1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 -2.6610 -0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0290 -3.4130 0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3610 -1.7940 1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7770 0.0780 -0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6980 -0.3250 -2.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 -0.7860 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 0.8420 -1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5100 -1.5890 -0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1120 -3.2910 -0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9760 -4.9620 -2.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5920 -0.0100 -1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8130 -0.8060 -1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4720 -3.1340 -1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7330 1.5410 -1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5190 1.0840 0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9530 2.6480 -0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9280 -3.0170 -2.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1210 -0.5970 -0.0260 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5800 -0.0450 0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5350 -1.9930 -0.9860 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 46 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 4 48 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 5 48 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 6 46 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 7 48 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 22 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END