PUBCHEM-ZINC02899232 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 0 0 0 0 0 0999 V2000 4.4330 1.3840 1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4460 0.0050 1.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4170 -0.6890 0.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 -0.0060 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 1.3730 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3780 2.0800 0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 3.5570 0.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2600 4.1700 1.0750 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3360 4.2260 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 5.6180 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4290 6.3760 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 7.7520 0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1260 8.3740 0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9650 7.6220 0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 6.2470 0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 10.1290 0.4100 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 10.4220 1.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2910 10.5560 0.9240 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 10.7700 -1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 10.9570 -1.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 11.4600 -3.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7520 11.7780 -3.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9950 11.5900 -3.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0780 11.0910 -1.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6640 12.2870 -5.0980 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 13.1050 -5.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 13.3320 -4.6340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 13.7240 -6.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 14.5720 -7.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 15.1470 -8.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 14.8850 -9.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5830 14.0470 -8.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6280 13.4700 -7.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 15.5060 -10.6320 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4210 16.2440 -10.9360 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 15.2780 -11.4340 O 0 5 0 0 0 0 0 0 0 0 0 0 3.4380 -2.1690 0.4520 N 0 3 0 0 0 0 0 0 0 0 0 0 4.3600 -2.7730 0.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 -2.7830 -0.0840 O 0 5 0 0 0 0 0 0 0 0 0 0 5.2350 1.9250 1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2630 -0.5340 1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 -0.5540 -0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 1.9050 -0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 3.7400 -0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3900 5.8910 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2610 8.3420 0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 8.1110 0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 5.6610 0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 10.7080 -1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 11.6050 -3.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8950 11.8360 -3.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0440 10.9480 -1.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3360 12.0520 -5.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 14.7760 -6.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 15.8020 -8.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 13.8470 -9.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 12.8190 -7.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 40 1 0 0 0 0 2 3 2 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 4 5 2 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 44 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 45 1 0 0 0 0 12 13 1 0 0 0 0 12 46 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 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 31 32 2 0 0 0 0 31 34 1 0 0 0 0 32 33 1 0 0 0 0 32 56 1 0 0 0 0 33 57 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 37 38 2 0 0 0 0 37 39 1 0 0 0 0 M CHG 1 34 1 M CHG 1 36 -1 M CHG 1 37 1 M CHG 1 39 -1 M END