IFLAB-ZINC04139200 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -1.4370 2.0610 0.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2310 0.5680 0.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 -0.1440 2.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -1.5130 2.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 -2.1710 0.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 -1.4590 -0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -0.0910 -0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 -3.6640 0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9250 -4.3350 0.6080 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9820 -5.6800 0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 -6.3370 0.7390 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2860 -6.3650 0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2920 -5.7090 0.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3440 -7.7110 0.2670 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6210 -8.3820 0.0140 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4280 -7.8130 0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8600 -8.4710 -1.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5840 -9.7910 0.6090 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.5480 -10.2760 0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5040 -10.5940 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7040 -11.4830 -1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5570 -12.1000 -1.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4270 -11.7120 -0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 -10.4970 0.2980 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.2210 -11.0470 2.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8670 -10.9160 4.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8410 -10.0910 4.7770 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9460 -8.7790 4.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3100 -8.8880 2.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 2.5590 1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 2.3710 -0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1500 2.3310 1.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6020 0.3700 2.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -2.0690 2.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 -1.9730 -1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 0.4650 -1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -3.9340 0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -3.9740 1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7290 -3.8100 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5390 -8.2350 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7540 -9.0640 -1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9950 -7.4690 -1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0010 -8.9440 -1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6850 -11.7040 -1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5770 -12.8390 -2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 -12.0840 -1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4500 -11.6270 2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1820 -11.5510 2.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8620 -11.9030 4.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8810 -10.4610 4.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7210 -8.2210 4.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9910 -8.2620 4.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2890 -9.3570 2.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3360 -7.8930 2.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3020 -9.7070 2.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 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 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 55 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 M END