CHEMBRIDGE-ZINC00450661 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 35 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7890 1.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.1750 0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -2.0920 -0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.7900 -1.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.3090 -2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 -0.0540 -3.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 0.4200 -4.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 0.6420 -5.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 0.3900 -4.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 -0.0900 -3.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4130 -0.3430 -2.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6230 -0.0960 -3.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 1.1500 -6.4250 N 0 3 0 0 0 0 0 0 0 0 0 0 0.9440 1.3730 -7.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 1.3460 -6.9840 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0290 -3.2580 -1.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -3.3940 1.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -3.3170 2.6280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -0.4640 2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 -0.2260 -2.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 0.6180 -4.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 0.5650 -4.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6470 -0.7170 -4.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4770 -0.3380 -2.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6680 0.9550 -3.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 -3.5520 -1.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 -2.9680 -2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -4.0960 -1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -4.3610 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 26 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 27 1 0 0 0 0 12 13 1 0 0 0 0 13 14 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 18 31 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END