PUBCHEM-ZINC03737878 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 1 0 0 0 0 0999 V2000 -0.3130 1.7800 1.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6060 0.2900 1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -0.4040 1.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -1.7710 1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 -2.5570 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 -3.9490 1.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 -4.5940 1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.7970 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 -2.3930 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -4.3970 1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3800 -3.6360 0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 -4.5350 2.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 -6.1150 1.3890 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8750 -6.4780 1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 -6.7330 2.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8570 -7.8350 2.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 -8.1020 3.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 -9.0620 3.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9970 -9.0500 5.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5490 -8.0890 6.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6040 -7.1240 5.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 -7.1540 4.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2040 -6.3390 3.6940 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 -5.5670 4.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9140 -10.0340 5.3620 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4610 -10.0780 6.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 -8.5330 0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 -8.1890 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2100 2.0580 0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 2.3600 1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 2.0540 2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 0.0360 2.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 0.0400 0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5380 -2.1250 1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 -4.5280 1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7230 -1.7460 1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3360 -5.3940 0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6670 -2.6650 0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3020 -4.2130 0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9470 -3.4700 -0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1130 -3.5570 3.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 -5.1380 3.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9700 -5.0200 2.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8520 -9.8140 3.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9170 -8.0580 7.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 -6.3810 6.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0140 -9.1600 6.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1690 -10.9110 6.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6830 -10.2670 7.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9670 -9.6180 1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8150 -8.2180 0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 -8.6600 0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -8.4860 -1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 -6.7000 0.0220 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2470 -6.2180 -0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3540 -6.4660 -0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 37 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 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 13 54 1 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 27 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 25 1 0 0 0 0 20 21 2 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 54 55 1 0 0 0 0 54 56 1 0 0 0 0 M CHG 1 54 1 M END