PUBCHEM-ZINC04562314 MOE2007 3D CORINA 3.40 0006 02.08.2006 65 67 0 0 0 0 0 0 0 0999 V2000 -0.3840 1.5140 0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 0.0640 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 -0.1870 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 -0.2960 1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -0.2340 2.5680 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 -1.3670 2.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -2.5150 3.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 -3.5100 4.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0520 -3.5710 3.9030 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 -4.3570 5.0830 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 -5.3810 5.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 -6.5200 6.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 -7.5660 7.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3880 -5.8210 7.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6650 -4.7680 7.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 -7.9250 9.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3260 -7.3770 10.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6470 -7.1080 10.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9180 -6.5690 12.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8750 -6.3000 13.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5600 -6.5680 12.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2840 -7.1040 11.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 0.8980 3.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 1.8730 3.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2270 0.9880 4.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 2.2410 5.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 2.4180 6.4590 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2850 1.2920 7.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 0.0430 6.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 -0.1390 5.4720 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 2.2130 0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 1.7530 -0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 1.6930 0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 -0.5840 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7980 0.4410 -1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.2340 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 0.0300 -2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3510 -1.3140 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 0.3680 1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 -1.0170 3.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 -1.7220 1.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7030 -3.0480 2.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 -2.1420 4.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -4.2460 5.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 -5.7830 5.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 -6.9950 5.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 -6.1220 6.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5740 -8.0560 6.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -8.3190 7.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7900 -5.3680 8.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1980 -6.2980 7.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -4.2530 7.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3830 -4.0010 6.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3090 -8.7500 9.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9220 -8.3200 8.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4790 -7.3110 10.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9440 -6.3620 12.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0890 -5.8850 14.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 -6.3640 13.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 -7.3110 11.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 3.1480 4.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7190 1.4250 8.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 -0.8530 7.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -6.9010 8.2610 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.6590 -6.4460 8.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 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 23 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 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 12 47 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 13 64 1 0 0 0 0 14 15 1 0 0 0 0 14 50 1 0 0 0 0 14 51 1 0 0 0 0 14 64 1 0 0 0 0 15 52 1 0 0 0 0 15 53 1 0 0 0 0 16 17 1 0 0 0 0 16 54 1 0 0 0 0 16 55 1 0 0 0 0 16 64 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 56 1 0 0 0 0 19 20 1 0 0 0 0 19 57 1 0 0 0 0 20 21 2 0 0 0 0 20 58 1 0 0 0 0 21 22 1 0 0 0 0 21 59 1 0 0 0 0 22 60 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 61 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 62 1 0 0 0 0 29 30 1 0 0 0 0 29 63 1 0 0 0 0 64 65 1 0 0 0 0 M CHG 1 64 1 M END