PUBCHEM-ZINC06583263 MOE2007 3D CORINA 3.40 0006 02.08.2006 75 79 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3800 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -0.6710 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4180 0.0300 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 1.4180 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0810 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6440 2.2500 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3250 3.6140 -0.4640 N 0 5 0 0 0 0 0 0 0 0 0 0 3.5090 4.5930 0.6160 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2050 4.1710 1.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6450 5.8240 0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6350 6.7660 1.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0190 6.7820 2.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0800 6.4780 1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9780 5.0080 0.6800 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5040 4.3920 1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6270 4.8360 -0.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3840 3.5780 -0.7290 N 0 5 0 0 0 0 0 0 0 0 0 0 7.8280 3.8230 -0.6970 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0630 4.4700 0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2750 4.5160 -1.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7130 5.0130 -1.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5440 3.9530 -1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9060 2.5770 -1.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5800 2.5040 -0.5430 C 0 0 3 0 0 0 0 0 0 0 0 0 8.7920 2.3230 0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7450 1.3390 -1.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4160 0.4340 0.0100 N 0 5 0 0 0 0 0 0 0 0 0 0 7.3290 -0.9780 -0.3580 C 0 0 3 0 0 0 0 0 0 0 0 0 7.9820 -1.5520 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7810 -1.2260 -1.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8660 -2.7280 -2.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6540 -3.4440 -1.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5160 -2.4370 -1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8910 -1.4610 -0.1660 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8040 -1.9680 0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9370 -0.2590 -0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5800 -0.7170 -0.0400 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9070 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -1.7510 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 3.1610 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0640 2.2790 0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 1.8230 -0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0470 6.3440 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 5.5010 0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 7.7730 1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8960 6.4230 2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2080 7.7680 2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0620 6.0300 2.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9220 7.1180 0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0720 6.6670 1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8580 4.8220 -1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3010 5.6730 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2210 3.8110 -2.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6230 5.3650 -2.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1420 5.2020 -2.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7170 5.9360 -1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5580 3.9480 -1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5780 4.1840 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7210 2.4180 -2.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5810 1.8040 -0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8310 1.7240 -1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3260 0.8360 -1.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0860 -0.7630 -2.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7790 -0.8020 -1.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8920 -2.8910 -3.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7790 -3.1270 -1.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3280 -4.2350 -2.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9250 -3.8780 -0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3500 -1.8870 -2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6050 -2.9700 -1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1900 0.4100 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0490 0.2580 -1.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4600 -1.6860 0.0690 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 39 1 0 0 0 0 2 3 2 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 41 1 0 0 0 0 4 5 2 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 45 1 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 13 14 1 0 0 0 0 13 49 1 0 0 0 0 13 50 1 0 0 0 0 14 15 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 53 1 0 0 0 0 17 54 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 21 55 1 0 0 0 0 21 56 1 0 0 0 0 22 23 1 0 0 0 0 22 57 1 0 0 0 0 22 58 1 0 0 0 0 23 24 1 0 0 0 0 23 59 1 0 0 0 0 23 60 1 0 0 0 0 24 25 1 0 0 0 0 24 61 1 0 0 0 0 24 62 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 63 1 0 0 0 0 27 64 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 35 1 0 0 0 0 31 32 1 0 0 0 0 31 65 1 0 0 0 0 31 66 1 0 0 0 0 32 33 1 0 0 0 0 32 67 1 0 0 0 0 32 68 1 0 0 0 0 33 34 1 0 0 0 0 33 69 1 0 0 0 0 33 70 1 0 0 0 0 34 35 1 0 0 0 0 34 71 1 0 0 0 0 34 72 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 37 38 1 0 0 0 0 37 73 1 0 0 0 0 37 74 1 0 0 0 0 38 75 1 0 0 0 0 M CHG 1 8 -1 M CHG 1 18 -1 M CHG 1 28 -1 M END