PUBCHEM-ZINC06245689 MOE2007 3D CORINA 3.40 0006 02.08.2006 78 83 0 0 1 0 0 0 0 0999 V2000 5.4050 -5.9410 -2.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 -6.0380 -1.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4320 -5.2200 -0.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 -5.3310 -0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 -6.2700 -1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 -7.0970 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1280 -6.9850 -2.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 -6.3230 -0.6490 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2030 -6.2470 0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 -7.6810 -0.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8150 -7.8250 -1.7260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4030 -8.7250 -0.1430 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 -10.0840 -0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5030 -10.9380 0.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 -11.4020 0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 -11.2780 -0.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -10.8270 -1.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 -5.1840 -1.1540 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 -4.6310 -2.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 -3.2710 -2.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 -2.7300 -3.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 -1.3710 -3.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 -0.8600 -5.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -1.7010 -6.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 -3.0540 -6.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -3.5910 -4.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 -4.8980 -4.8240 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 -5.3940 -3.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0400 -4.6730 -0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0470 -4.9650 0.8950 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0970 -3.8270 -0.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9480 -2.9510 -0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8550 -2.4560 -1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5220 -3.0660 -2.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4540 -3.8940 -2.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1000 -3.0220 -3.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7880 -1.5900 -5.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5700 -0.2310 -6.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1910 -0.0360 -6.6650 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3670 -0.0650 -5.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4660 -1.4130 -4.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0020 -6.6150 -1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5530 -6.2090 -3.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7760 -4.9190 -2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0640 -4.4890 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7050 -4.6710 0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 -7.8340 -2.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -7.6420 -3.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 -8.5520 0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 -10.0350 -0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5570 -10.4040 1.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 -11.8140 1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6530 -10.7670 1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0810 -12.4290 0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8510 -10.5290 -1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 -12.2220 -1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 -11.7090 -1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1710 -10.2200 -2.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 -2.6360 -1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 -0.7060 -3.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 0.1900 -5.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7690 -1.3120 -7.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -3.7060 -7.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -6.4550 -3.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9230 -2.7220 0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6690 -1.7640 -0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6680 -3.7920 -4.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1800 -3.1970 -3.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8300 -1.7180 -5.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4820 -2.4090 -6.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1430 -0.1770 -7.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9090 0.5870 -5.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3360 0.1110 -5.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 0.7600 -4.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1350 -2.2330 -5.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8970 -1.3980 -3.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9230 -1.6880 -4.4270 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.2340 -0.9590 -3.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 45 1 0 0 0 0 4 5 1 0 0 0 0 4 46 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 47 1 0 0 0 0 7 48 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 18 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 13 17 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 53 1 0 0 0 0 15 54 1 0 0 0 0 16 17 1 0 0 0 0 16 55 1 0 0 0 0 16 56 1 0 0 0 0 17 57 1 0 0 0 0 17 58 1 0 0 0 0 18 19 1 0 0 0 0 18 29 1 0 0 0 0 19 20 1 0 0 0 0 19 28 2 0 0 0 0 20 21 2 0 0 0 0 20 59 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 2 0 0 0 0 22 60 1 0 0 0 0 23 24 1 0 0 0 0 23 61 1 0 0 0 0 24 25 2 0 0 0 0 24 62 1 0 0 0 0 25 26 1 0 0 0 0 25 63 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 28 64 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 2 0 0 0 0 31 35 1 0 0 0 0 32 33 1 0 0 0 0 32 65 1 0 0 0 0 33 34 2 0 0 0 0 33 66 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 36 67 1 0 0 0 0 36 68 1 0 0 0 0 36 77 1 0 0 0 0 37 38 1 0 0 0 0 37 69 1 0 0 0 0 37 70 1 0 0 0 0 37 77 1 0 0 0 0 38 39 1 0 0 0 0 38 71 1 0 0 0 0 38 72 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 40 73 1 0 0 0 0 40 74 1 0 0 0 0 41 75 1 0 0 0 0 41 76 1 0 0 0 0 41 77 1 0 0 0 0 77 78 1 0 0 0 0 M CHG 1 77 1 M END