IFLAB-ZINC04262927 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 0.0050 1.3970 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -0.0320 -0.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1850 -0.6620 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 -2.0480 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4650 -2.6890 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6380 -1.9460 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5800 -0.5580 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3560 0.0810 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8780 -2.5940 -0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9800 -1.6230 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3130 -2.3690 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4390 -3.2910 -1.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3370 -4.2620 -1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0040 -3.5160 -1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6730 -3.9360 -1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0320 -4.7270 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2540 -5.3670 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1360 -5.2260 -0.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7930 -4.4410 -2.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5600 -3.7840 -2.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2010 -2.9650 -3.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9160 -2.3160 -4.1020 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.3740 -5.8800 -0.9600 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.4580 -5.2920 -1.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3460 -4.2320 -2.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.7730 -5.9300 -1.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.9480 -5.4450 -1.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.9450 -6.3710 -1.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.3440 -7.3680 -0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0350 -7.1020 -0.7720 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 1.7720 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 1.7530 -0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 1.7570 0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 -2.6260 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5100 -3.7680 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4920 0.0210 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 1.1600 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8720 -0.9590 0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9580 -1.0360 -0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3470 -2.9340 1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1340 -1.6520 0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3590 -4.8490 -0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4450 -4.9260 -1.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9700 -2.9510 -2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1830 -4.2330 -1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3520 -4.8420 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5270 -5.9820 0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4780 -4.3330 -2.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4510 -6.7560 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.0820 -4.5260 -2.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.9960 -6.3000 -1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.8380 -8.2390 -0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 21 22 3 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 M END