IBS-ZINC04029603 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 64 0 0 1 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 0.7400 -0.5180 1.2370 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1790 -0.2490 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1550 0.0500 1.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 -0.5630 2.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7970 -2.0890 2.4780 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4500 -2.5500 2.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8340 -2.0430 1.1320 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4550 -2.2990 0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 -2.6050 0.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8030 -3.9220 1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 -4.4550 1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0600 -3.6690 0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8040 -2.3540 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5400 -1.8110 0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 -0.5060 0.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6400 -2.5450 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3570 -2.6620 3.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8040 -3.1180 4.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3640 -3.6910 5.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 -5.1570 5.8510 N 0 3 0 0 0 0 0 0 0 0 0 0 4.8920 -5.7270 7.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9380 -7.2520 6.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5190 -7.7860 6.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9190 -7.1290 5.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9480 -5.6080 5.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1360 -5.5980 4.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 -0.5050 -1.2630 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 2.7180 -0.2120 0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1110 1.1340 1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8650 -0.2260 2.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3020 -0.2420 3.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -4.5370 1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2620 -5.4830 1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0430 -4.0850 0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5870 -1.7440 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6690 -2.2100 1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6190 -3.6330 1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2340 -2.1170 0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3940 -3.3550 6.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7710 -3.3630 6.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9020 -5.3440 7.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2660 -5.4450 7.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5640 -7.5350 6.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3520 -7.6730 7.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5530 -8.8660 6.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9060 -7.5470 7.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5030 -7.4090 4.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 -7.4610 5.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3630 -5.3280 6.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5210 -5.1370 4.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1650 -5.2620 4.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1140 -6.6860 4.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7230 -5.1740 3.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 -0.1300 -1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -1.5950 -1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -0.1470 -2.1410 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 17 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 9 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 3 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 22 28 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 29 59 1 0 0 0 0 29 60 1 0 0 0 0 29 61 1 0 0 0 0 M CHG 1 22 1 M END