IFLAB-ZINC04032768 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -1.8480 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7720 -2.3970 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9320 -3.7690 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 -4.5960 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 -4.0510 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 -2.6790 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0010 -6.0920 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0730 -6.5830 -1.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9900 -5.7960 -2.3530 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2310 -7.8980 -1.6860 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3020 -8.3750 -3.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4820 -9.8950 -3.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5540 -10.3860 -4.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 -10.8400 -5.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5390 -11.3100 -6.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 -11.7900 -7.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -12.2220 -8.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7850 -12.1890 -9.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9010 -11.7200 -8.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7920 -11.2750 -7.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8930 -10.8020 -6.4550 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7560 -10.7790 -6.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7890 -10.3770 -5.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7840 -9.9700 -4.6090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9050 -12.6710 -10.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -12.7390 -9.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6390 -1.7520 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9240 -4.1970 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 -4.6980 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -2.2540 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1550 -6.5600 0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9220 -6.3510 0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2980 -8.5280 -0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1480 -7.9070 -3.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 -8.1160 -3.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 -10.3630 -2.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4040 -10.1540 -2.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 -10.8540 -4.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -11.8190 -6.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8570 -11.6980 -8.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1330 -13.7370 -10.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7040 -12.1260 -11.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 -12.4990 -11.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 -13.8130 -9.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -12.5390 -10.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5520 -12.2390 -8.8440 H 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 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 2 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 29 1 0 0 0 0 21 22 2 0 0 0 0 21 28 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 M END