PUBCHEM-ZINC02951568 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 -1.9770 3.6240 -0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6410 2.1620 -0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 1.5980 -1.5750 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 1.6590 -1.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 0.3810 -0.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 1.0410 -2.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8660 1.0780 -2.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4930 0.5200 -4.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7360 -0.1030 -5.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3250 -0.6970 -6.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5620 -1.2920 -7.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 -1.3520 -6.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 -1.8970 -7.7850 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 -0.7730 -5.8010 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 -0.1520 -4.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7350 0.4030 -3.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2610 -1.8780 -8.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4800 -1.7890 -8.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4080 -2.4790 -9.2420 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7330 -3.1240 -10.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0610 -3.2920 -10.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3650 -3.9560 -12.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3450 -4.4820 -12.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0010 -4.3440 -12.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6810 -3.6230 -11.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2340 -3.4030 -10.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 -4.9890 -13.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 -5.7410 -12.7700 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0670 4.2200 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5840 3.7510 -1.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5360 4.0350 0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 2.1000 0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5450 1.5770 -0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 1.8710 -2.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 2.5010 -0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 0.4510 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 0.2090 0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 -0.4970 -1.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5190 1.5570 -2.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5750 0.5880 -4.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4060 -0.6360 -6.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 0.3100 -3.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 -2.4570 -9.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8950 -2.9220 -10.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4000 -4.0750 -12.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5870 -5.0140 -13.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -4.1080 -10.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4440 -3.5100 -11.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -2.3770 -10.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 -4.7450 -14.5810 O 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 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 16 2 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 15 2 0 0 0 0 10 11 2 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 27 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 2 0 0 0 0 M CHG 1 28 -1 M END