IFLAB-ZINC04272761 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 -2.0950 1.3190 0.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 -0.0570 0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4960 -0.6480 2.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 -1.9240 2.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 -2.6240 1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 -2.0480 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 -0.7600 -0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 -0.1880 -1.5290 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9510 -0.7830 -2.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 -0.0210 -3.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 1.3340 -4.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 1.5100 -5.6440 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6380 0.2530 -6.1320 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7880 -0.7010 -5.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 -2.0250 -5.3330 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0710 -2.7090 -4.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 -2.1300 -2.9680 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -4.0800 -4.2620 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7030 -4.8380 -3.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 -6.1410 -2.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 -6.0900 -5.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 -4.7870 -5.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 -8.2980 -4.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3500 -9.2570 -3.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5490 -8.8930 -4.3270 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2040 -9.5950 -4.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5670 0.0440 -7.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 2.0360 0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8840 1.3150 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 1.6700 1.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 -0.1130 2.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 -2.3680 3.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -3.6160 1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -2.6130 -0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 0.8210 -1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 2.2050 -3.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 -4.2810 -2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7650 -5.0750 -3.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -5.9380 -2.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3710 -6.7740 -2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 -6.6890 -6.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -5.8900 -5.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0660 -5.0150 -5.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -4.1930 -6.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -8.2480 -3.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -8.5910 -5.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0880 -10.2930 -3.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5370 -9.1630 -2.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 0.4140 -7.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 -1.0200 -7.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 0.5970 -8.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 -6.9230 -4.2250 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8620 -7.1570 -4.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 17 2 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 52 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 52 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END