PUBCHEM-ZINC06026596 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 -0.3670 1.6340 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 0.1270 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4750 -0.4730 0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5520 -1.8430 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 -2.7010 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 -4.0970 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 -4.6540 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0120 -3.7780 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8460 -2.3860 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8760 -1.4810 -0.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2130 -1.9750 -0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1520 -0.7820 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1160 -6.1690 -0.0940 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3550 -6.4510 -1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -6.3730 -0.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -4.9680 0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1720 -6.6790 0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4730 -7.0300 0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3300 -7.5000 1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8880 -7.6080 2.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5810 -7.2580 3.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7110 -6.8110 2.1620 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9560 -6.9900 -0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 2.1450 0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 1.9540 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 1.9530 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 -0.1640 -0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 -0.1650 0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 -2.3050 0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0120 -4.1920 -0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4130 -2.5830 -1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3810 -2.5660 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9620 -0.1450 0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9940 -0.1630 -0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1960 -1.1080 -0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -6.3900 -1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -7.0390 -0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4380 -4.5180 -0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 -5.0140 1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3520 -7.7920 1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5470 -7.9660 3.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1880 -7.3320 4.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4860 -7.7920 -1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0420 -7.1240 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7300 -6.0290 -1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 -6.9280 0.2190 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.7850 -6.9080 1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 -7.9170 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 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 29 1 0 0 0 0 6 7 1 0 0 0 0 6 16 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 30 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 13 46 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 15 46 1 0 0 0 0 16 38 1 0 0 0 0 16 39 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 23 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 M CHG 1 46 1 M END