IFLAB-ZINC05251401 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3740 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.0080 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -0.6890 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 0.0120 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.3940 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 2.0750 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 -0.7310 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1380 -0.9620 -1.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4690 -1.7160 -1.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8890 -1.9360 -2.8860 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0410 -2.5860 -3.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7300 -2.9880 -2.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4680 -2.8100 -4.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7790 -2.4080 -5.4730 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6200 -3.4600 -4.8190 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9640 -3.7730 -6.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9720 -3.9140 -7.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3150 -4.2220 -8.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6440 -4.3910 -8.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6330 -4.2520 -7.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2980 -3.9380 -6.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3580 -3.7830 -5.4660 N 0 3 0 0 0 0 0 0 0 0 0 0 12.5300 -3.8390 -5.7920 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0570 -3.6000 -4.3000 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9570 1.9060 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 -0.5560 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -1.7690 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 1.9410 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 3.1550 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4560 -0.1430 0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5790 -1.6920 0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3810 -1.5490 -2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2580 -0.0010 -1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2260 -1.1280 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3480 -2.6760 -0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3380 -1.6150 -3.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2110 -3.7100 -4.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9350 -3.7820 -6.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5450 -4.3320 -9.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9100 -4.6330 -9.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6700 -4.3840 -8.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END