PUBCHEM-ZINC03872463 MOE2007 3D CORINA 3.40 0006 02.08.2006 71 70 0 0 1 0 0 0 0 0999 V2000 -0.9040 1.6830 -1.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 0.1730 -1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 -0.1040 0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1560 -0.4790 -1.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0180 -2.0000 -1.3560 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5630 -2.2650 -0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4020 -2.6450 -1.4580 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0220 -2.3060 -0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2620 -4.1440 -1.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5510 -4.8170 -2.3690 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8160 -4.7380 -0.2770 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7500 -6.1990 -0.1970 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4190 -6.6340 -0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 -6.6610 -0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 -6.3200 -1.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 -5.9510 0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1700 -6.6460 1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3490 -5.8250 2.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3460 -7.9570 1.4390 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8530 -8.3840 2.7450 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4670 -7.7200 3.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3820 -8.3290 2.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8400 -6.8730 2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9180 -9.1250 1.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4020 -9.7940 3.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9390 -10.4700 2.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5120 -10.3060 4.2650 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1780 -11.7110 4.5110 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3480 -12.0050 3.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7800 -11.8910 5.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 -11.1260 6.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 -10.5010 5.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3770 -12.5720 4.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4040 -12.0640 3.8230 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0120 -2.2700 -2.6940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 2.1470 -1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 1.8800 -2.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6250 2.0980 -0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -0.2430 -1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 0.3600 0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 0.3120 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 -1.1800 0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8560 -0.1300 -0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5290 -0.2080 -2.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5380 -4.1980 0.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 -7.7390 -0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9030 -5.2370 -2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -6.7400 -2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6760 -6.7400 -2.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 -6.2620 1.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -6.2130 0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 -4.8730 0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1380 -8.6170 0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7630 -8.7590 3.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4590 -6.4430 1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9290 -6.8340 2.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4580 -6.3060 3.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6650 -10.1780 1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0010 -9.0160 1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4700 -8.7500 0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8120 -9.7430 4.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5770 -11.5140 6.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6180 -12.9490 6.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5130 -2.5390 -3.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 -3.4870 -2.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 -11.1400 7.4790 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3040 -13.9030 4.3610 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 -2.4830 -2.4540 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 -2.1820 -3.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0980 -14.4140 4.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 -10.6340 7.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 39 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 3 42 1 0 0 0 0 4 5 1 0 0 0 0 4 43 1 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 68 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 35 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 46 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 16 52 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 53 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 25 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 54 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 23 57 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 61 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 33 1 0 0 0 0 30 31 1 0 0 0 0 30 62 1 0 0 0 0 30 63 1 0 0 0 0 31 32 2 0 0 0 0 31 66 1 0 0 0 0 33 34 2 0 0 0 0 33 67 1 0 0 0 0 35 64 1 0 0 0 0 65 68 1 0 0 0 0 66 71 1 0 0 0 0 67 70 1 0 0 0 0 68 69 1 0 0 0 0 M END