IBS-ZINC05452021 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 0.0580 -0.8290 1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.0600 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 1.1470 0.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -0.7140 -1.1540 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 -2.1840 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 -2.6540 -2.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6840 -1.9890 -3.4980 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 -0.5340 -3.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 0.0240 -2.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -2.5130 -4.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 -2.0160 -5.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2870 -2.5340 -6.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1800 -3.5500 -6.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2420 -4.0460 -5.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4110 -3.5330 -4.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0190 -4.0750 -7.4400 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2680 -4.4710 -7.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6390 -4.4510 -5.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1870 -4.9280 -8.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5110 -5.3690 -8.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9580 -5.6860 -9.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9540 -5.4430 -10.1180 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9970 -5.5800 -11.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9260 -4.9970 -9.4820 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.3410 -6.2110 -9.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9520 -6.7030 -8.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8030 -5.6200 -7.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3250 -5.4880 -6.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 -1.0390 1.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -1.7680 1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -0.2380 2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 -2.5260 -1.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 -2.5850 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 -3.7340 -2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9070 -2.4010 -1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 -0.0750 -4.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8450 -0.3100 -2.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 1.0820 -2.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 -0.1020 -2.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 -1.2250 -6.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2390 -2.1480 -7.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9370 -4.8370 -4.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4560 -3.9220 -3.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7010 -4.1530 -8.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9580 -5.4140 -9.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2810 -7.0380 -10.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0090 -6.9220 -8.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4370 -7.6070 -7.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1600 -4.6680 -7.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3890 -5.8930 -6.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0130 -6.3720 -6.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1860 -4.5980 -6.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 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 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 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 28 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 M END