NCID-ZINC05022525 MOE2007 3D CORINA 3.40 0006 02.08.2006 74 79 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3160 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -0.6770 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 0.0500 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 1.4530 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 2.0380 0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5760 1.8990 -0.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3850 0.8020 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 -0.2820 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0120 3.2980 -0.0190 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3380 3.9030 0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0750 3.8450 -1.4620 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1750 4.4140 -1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3140 4.7680 -1.4600 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0260 5.7940 -1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8530 4.6690 -0.0160 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4630 5.4860 0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3640 3.4020 0.4770 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3830 4.6900 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8580 4.7160 1.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2880 4.3000 -2.3940 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2450 2.7760 -2.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 -2.0600 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -2.8010 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -4.3030 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1380 -5.0770 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 -6.5790 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1130 -7.3200 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 -8.7040 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3080 -9.4300 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2350 -10.8330 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0420 -11.4180 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 -10.6970 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 -9.3760 -0.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5320 -11.2790 -0.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3420 -10.1820 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6210 -9.0990 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9680 -12.6780 -0.0140 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2830 -13.2900 0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0600 -13.2090 -1.4620 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1640 -13.7760 -1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2980 -14.1320 -1.4460 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.0160 -15.1550 -1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8090 -14.0500 0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.4070 -14.8730 0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3110 -12.7880 0.5070 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3380 -14.0710 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7880 -14.1120 1.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2910 -13.6540 -2.3560 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2480 -12.1300 -2.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 1.8230 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4640 0.8280 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7580 3.7980 -0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7340 5.5780 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8220 4.7300 1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0880 4.8430 -2.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2900 3.0630 -3.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.5400 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 -2.5460 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6890 -2.5370 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -4.5590 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -4.5680 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7030 -4.8220 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 -4.8130 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 -6.8340 -0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 -6.8430 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9560 -6.8400 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -11.2040 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4210 -10.2090 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7240 -13.1740 -0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7000 -14.9530 -0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7500 -14.1270 1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0910 -14.1970 -2.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3120 -12.4070 -3.3050 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 51 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 8 52 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 22 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 53 1 0 0 0 0 19 54 1 0 0 0 0 20 55 1 0 0 0 0 21 56 1 0 0 0 0 22 57 1 0 0 0 0 23 24 1 0 0 0 0 23 58 1 0 0 0 0 24 25 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 25 26 1 0 0 0 0 25 61 1 0 0 0 0 25 62 1 0 0 0 0 26 27 1 0 0 0 0 26 63 1 0 0 0 0 26 64 1 0 0 0 0 27 28 1 0 0 0 0 27 65 1 0 0 0 0 27 66 1 0 0 0 0 28 29 1 0 0 0 0 28 67 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 37 1 0 0 0 0 31 32 1 0 0 0 0 31 35 1 0 0 0 0 32 33 2 0 0 0 0 33 34 1 0 0 0 0 33 68 1 0 0 0 0 35 36 1 0 0 0 0 35 38 1 0 0 0 0 36 37 2 0 0 0 0 36 69 1 0 0 0 0 38 39 1 0 0 0 0 38 40 1 0 0 0 0 38 46 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 40 50 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 42 49 1 0 0 0 0 44 45 1 0 0 0 0 44 46 1 0 0 0 0 44 47 1 0 0 0 0 47 48 1 0 0 0 0 47 70 1 0 0 0 0 47 71 1 0 0 0 0 48 72 1 0 0 0 0 49 73 1 0 0 0 0 50 74 1 0 0 0 0 M END