NCID-ZINC03874677 MOE2007 3D CORINA 3.40 0006 02.08.2006 70 72 0 0 1 0 0 0 0 0999 V2000 0.9200 -0.3260 -2.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -1.5620 -1.2090 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0880 -2.4270 -1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7550 -1.5280 0.0060 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7810 -1.2790 -0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 -0.5440 1.0640 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2990 0.4850 0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 -0.8810 1.4220 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6010 -0.2100 2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 -0.8740 0.1500 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1250 0.1220 -0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 -1.7950 -0.8000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3790 -1.3040 0.5280 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4460 -0.1490 0.8680 P 0 0 3 0 0 0 0 0 0 0 0 0 -2.8510 1.0690 1.5090 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3510 0.1070 -0.4700 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8200 -0.9940 -1.3300 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0100 -1.8870 -0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1080 -0.5590 -2.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3120 -0.2730 -1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4530 0.3440 -1.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8120 -1.5370 -0.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7380 -1.3510 -2.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7720 -0.6200 -2.5780 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0030 -2.5260 -3.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1250 -3.1530 -4.0490 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2140 -2.5560 -4.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8040 -4.6160 -3.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9680 -4.7840 -2.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 -4.8650 -2.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2040 -5.0190 -1.1130 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -5.0720 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 -5.0810 -0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4310 -4.9290 -1.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7050 -4.9490 -0.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8070 -5.1060 0.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6650 -5.2540 1.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 -5.2490 1.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8360 -3.3280 -5.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0900 -3.5160 -5.3510 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 -2.2140 1.9990 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 -2.5180 1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0500 -0.6270 2.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9900 -1.5580 2.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 -2.8480 0.5910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 -2.9730 1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 -0.2220 -2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 -0.4010 -2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 0.5970 -1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9070 0.7890 -1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8890 0.3400 -2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4010 -1.3240 -2.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0240 0.4570 -0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7950 -0.3390 -2.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3090 0.5780 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1310 1.2760 -2.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0850 -2.3120 -1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0540 -1.9530 0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6970 -1.3190 0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8830 -3.0100 -2.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7320 -5.1890 -3.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2730 -5.0990 -4.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 -4.8070 -3.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6010 -4.8450 -1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7880 -5.1180 1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7640 -5.3780 2.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 -5.3640 1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0850 -3.2900 -6.4390 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.4380 -0.9210 1.8730 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2710 -1.1920 1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 47 1 0 0 0 0 1 48 1 0 0 0 0 1 49 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 45 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 43 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 41 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 14 69 1 0 0 0 0 16 17 1 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 23 1 0 0 0 0 19 20 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 53 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 21 56 1 0 0 0 0 22 57 1 0 0 0 0 22 58 1 0 0 0 0 22 59 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 60 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 39 1 0 0 0 0 28 29 1 0 0 0 0 28 61 1 0 0 0 0 28 62 1 0 0 0 0 29 30 2 0 0 0 0 29 34 1 0 0 0 0 30 31 1 0 0 0 0 30 63 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 33 38 2 0 0 0 0 34 35 2 0 0 0 0 35 36 1 0 0 0 0 35 64 1 0 0 0 0 36 37 2 0 0 0 0 36 65 1 0 0 0 0 37 38 1 0 0 0 0 37 66 1 0 0 0 0 38 67 1 0 0 0 0 39 40 2 0 0 0 0 39 68 1 0 0 0 0 41 42 1 0 0 0 0 43 44 1 0 0 0 0 45 46 1 0 0 0 0 69 70 1 0 0 0 0 M CHG 1 68 -1 M END