PUBCHEM-ZINC02834719 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 -0.7330 1.6470 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 0.2700 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3750 -0.6260 -0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 -2.0650 -0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6150 -2.4170 1.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 -3.6440 1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -4.4820 0.4690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 -3.9720 2.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -5.2560 3.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0860 -5.5220 4.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 -4.5380 5.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 -5.2330 6.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 -6.5960 6.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 -6.7330 4.8620 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2480 -7.6530 6.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 -7.4090 8.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9470 -8.4350 9.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0880 -9.7140 8.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8110 -9.9660 7.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 -8.9560 6.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9670 -11.3360 6.7430 N 0 3 0 0 0 0 0 0 0 0 0 0 3.2680 -12.3310 7.5510 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8040 -11.5580 5.4550 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0540 -3.0310 3.7100 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 -1.8840 3.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 -1.6580 2.6490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -0.9030 4.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 0.3090 4.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 1.2210 5.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 0.9380 6.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 -0.2610 6.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -1.1800 5.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 2.2620 0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 1.9270 -1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5980 1.8030 0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2530 -0.5180 0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6420 -0.3940 -1.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 -2.7410 -0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -2.1520 -0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7830 -1.7670 1.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -6.0400 2.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 -3.4740 5.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9810 -4.8220 7.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 -6.4140 8.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1660 -8.2500 10.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4160 -10.5190 9.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 -9.1560 5.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -3.1810 4.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9630 0.5310 3.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 2.1580 5.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5490 1.6550 7.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6650 -0.4760 7.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 -2.1130 5.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 12 13 2 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 31 2 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 31 52 1 0 0 0 0 32 53 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END