IBS-ZINC04088845 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.8140 1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.1000 0.6760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.1950 -0.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.8800 -1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.6560 -2.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -1.7450 -3.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -1.5450 -4.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 -2.6420 -5.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -3.9300 -5.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -4.9050 -5.8230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -4.1080 -3.7640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -3.0610 -2.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -3.2730 -1.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -4.6790 -1.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -2.4840 -7.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 -2.5370 -7.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3410 -2.3800 -9.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 -2.2400 -9.7860 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 -2.3950 -9.9040 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4720 -2.2420 -11.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9020 -2.2950 -11.9020 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5090 -1.5450 -11.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8900 -2.0150 -13.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2150 -0.7560 -13.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2040 -0.5000 -15.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8680 -1.5030 -16.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5440 -2.7630 -15.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5590 -3.0200 -14.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4530 -3.5920 -11.6660 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -0.1580 -5.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.4810 2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 0.3520 -2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -5.0320 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -5.3320 -1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5770 -4.6910 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 -3.2920 -7.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 -1.5260 -7.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9490 -1.7300 -7.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8150 -3.4950 -7.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3390 -2.5070 -9.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8870 -3.0500 -11.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0210 -1.2840 -11.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4770 0.0280 -13.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4570 0.4840 -15.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8580 -1.3030 -17.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2810 -3.5460 -16.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3090 -4.0050 -13.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9620 -4.3100 -12.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 0.1900 -5.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 -0.1790 -6.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 0.5180 -4.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 15 2 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 14 2 0 0 0 0 9 10 2 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 31 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 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 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 M END