IBS-ZINC02130789 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 52 0 0 1 0 0 0 0 0999 V2000 0.0590 2.2290 0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 0.8650 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 -0.0280 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 0.4180 0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4410 1.8040 0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 2.6990 0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3480 -0.4940 0.0960 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2520 -1.8190 -0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 -2.4180 -0.7230 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5960 -2.4810 -0.0940 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5430 -3.0700 0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1840 -3.2880 -1.2440 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0390 -3.8520 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2390 -1.1770 -1.3230 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5460 -1.3010 0.0430 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2500 -1.4900 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6510 -0.1620 0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0910 0.8580 0.9360 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2320 0.1430 -2.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1790 0.8880 -2.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4670 2.0910 -3.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7940 2.5260 -3.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8550 1.7650 -2.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5440 0.5850 -2.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4390 -0.3260 -1.7040 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7800 -1.4040 -1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3270 -2.3360 -0.5520 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2570 -4.2940 -1.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0110 -5.1640 -2.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1930 -6.2660 -3.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0200 -6.4480 -3.1890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 2.9230 0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1870 0.4840 0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -1.0830 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4360 2.2400 0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5550 3.7660 0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1490 0.5590 -2.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6550 2.6930 -3.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9940 3.4620 -3.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8800 2.0920 -3.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4440 -0.2440 -1.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7950 -4.9320 -1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4410 -3.7820 -2.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4270 -4.5320 -3.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8550 -5.6540 -2.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7190 -2.2740 -2.1660 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9700 -1.9390 -2.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8140 -6.8790 -4.5310 O 0 5 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 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 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 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 46 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 14 26 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 26 27 2 0 0 0 0 28 29 1 0 0 0 0 28 42 1 0 0 0 0 28 43 1 0 0 0 0 29 30 1 0 0 0 0 29 44 1 0 0 0 0 29 45 1 0 0 0 0 30 31 2 0 0 0 0 30 48 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 48 -1 M END