NCID-ZINC04773564 MOE2007 3D Structure written by MMmdl. 88 90 0 0 1 0 0 0 0 0999 V2000 2.5150 -1.6130 -2.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 -0.9740 -1.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 1.3490 -2.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2850 2.5990 -2.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 1.0120 -0.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 0.6570 0.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 1.2450 1.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 0.9550 3.2930 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0420 -0.1320 3.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1130 1.5020 4.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 1.5980 3.5940 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1970 1.1960 4.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9960 0.1160 5.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9860 -0.2920 6.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2050 0.3750 6.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4350 1.4530 5.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4450 1.8640 4.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 3.0000 3.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8710 3.3900 2.8550 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0370 3.6620 3.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2860 4.7070 2.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5260 5.3320 2.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5210 4.9170 3.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2990 3.8750 4.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0290 3.2480 4.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7410 2.1280 5.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5910 1.7440 6.2980 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2820 3.4330 5.4480 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6720 3.8430 5.5040 C 0 0 3 0 0 0 0 0 0 0 0 0 10.0480 4.1030 4.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8130 5.0460 6.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5150 2.6640 6.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4610 1.4470 5.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2550 0.2780 5.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0550 -0.8960 3.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4740 -1.6710 2.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2420 -2.2410 5.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9350 -2.5750 6.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 -2.6810 -2.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9810 -1.1690 -3.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2110 -1.5150 -1.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -1.4670 -0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -1.0470 -2.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 0.7560 -3.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 1.5800 -3.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 3.2390 -1.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2910 2.3430 -2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 3.1890 -3.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6750 0.5790 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 2.0990 -0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -0.4300 0.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6330 1.0450 1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 2.3290 1.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 0.8220 1.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2170 2.5880 4.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 1.0440 3.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8770 1.2950 5.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4740 2.4630 3.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 -0.4260 5.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8010 -1.1300 6.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9690 0.0470 7.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5190 5.0400 2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7250 6.1470 2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4740 5.4370 3.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9560 2.7310 6.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4580 4.8130 7.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8590 5.3630 6.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2300 5.8990 6.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5590 2.9830 6.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1630 2.3700 7.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4210 1.1320 4.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8480 1.7330 4.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3240 0.4970 5.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8650 0.0200 6.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1860 0.1500 3.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0210 -1.2960 3.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1450 -1.6030 1.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3410 -2.7320 2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5030 -1.2640 2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4900 -3.0400 4.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0720 -2.1220 6.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6510 -1.8130 6.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1180 -2.6740 5.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0290 -3.5270 6.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 0.4990 -1.5380 N 0 3 0 0 0 0 0 0 0 0 0 0 2.2600 0.5890 -1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1030 -0.9440 4.7750 N 0 3 0 0 0 0 0 0 0 0 0 0 10.1440 -0.9200 4.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 42 1 0 0 0 0 2 43 1 0 0 0 0 2 85 1 0 0 0 0 3 4 1 0 0 0 0 3 44 1 0 0 0 0 3 45 1 0 0 0 0 3 85 1 0 0 0 0 4 46 1 0 0 0 0 4 47 1 0 0 0 0 4 48 1 0 0 0 0 5 6 1 0 0 0 0 5 49 1 0 0 0 0 5 50 1 0 0 0 0 5 85 1 0 0 0 0 6 7 1 0 0 0 0 6 51 1 0 0 0 0 6 52 1 0 0 0 0 7 8 1 0 0 0 0 7 53 1 0 0 0 0 7 54 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 10 55 1 0 0 0 0 10 56 1 0 0 0 0 10 57 1 0 0 0 0 11 12 1 0 0 0 0 11 58 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 59 1 0 0 0 0 14 15 2 0 0 0 0 14 60 1 0 0 0 0 15 16 1 0 0 0 0 15 61 1 0 0 0 0 16 17 2 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 62 1 0 0 0 0 22 23 1 0 0 0 0 22 63 1 0 0 0 0 23 24 2 0 0 0 0 23 64 1 0 0 0 0 24 25 1 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 28 29 1 0 0 0 0 28 65 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 31 66 1 0 0 0 0 31 67 1 0 0 0 0 31 68 1 0 0 0 0 32 33 1 0 0 0 0 32 69 1 0 0 0 0 32 70 1 0 0 0 0 33 34 1 0 0 0 0 33 71 1 0 0 0 0 33 72 1 0 0 0 0 34 73 1 0 0 0 0 34 74 1 0 0 0 0 34 87 1 0 0 0 0 35 36 1 0 0 0 0 35 75 1 0 0 0 0 35 76 1 0 0 0 0 35 87 1 0 0 0 0 36 77 1 0 0 0 0 36 78 1 0 0 0 0 36 79 1 0 0 0 0 37 38 1 0 0 0 0 37 80 1 0 0 0 0 37 81 1 0 0 0 0 37 87 1 0 0 0 0 38 82 1 0 0 0 0 38 83 1 0 0 0 0 38 84 1 0 0 0 0 85 86 1 0 0 0 0 87 88 1 0 0 0 0 M CHG 1 85 1 M CHG 1 87 1 M END