ACROSORGANICS-ZINC03861477 MOE2007 3D Structure written by MMmdl. 58 60 0 0 0 0 0 0 0 0999 V2000 -0.7050 1.5660 3.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 1.0720 2.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7290 1.5790 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 1.5930 -1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 1.1200 -2.4370 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5570 1.4550 -3.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7070 2.2450 -3.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1980 2.5820 -5.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5640 2.1460 -6.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 1.3600 -6.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 1.0130 -4.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 0.1810 -4.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0360 0.2110 -3.7880 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6190 -0.6920 -5.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 -1.8390 -5.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -2.6290 -6.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1600 -2.2830 -8.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3900 -1.1430 -8.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 -0.3410 -7.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 0.8780 -7.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 1.4700 -8.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0730 2.4960 -7.4460 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2780 3.3240 -7.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6240 3.5620 -9.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8830 4.4260 -9.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2290 4.6640 -10.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4880 5.5280 -10.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 1.2050 4.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7200 2.6560 3.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7280 1.1880 3.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -0.0180 2.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 1.4500 2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 2.6690 1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7510 1.2020 1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7750 1.2150 -1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7680 2.6820 -1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 0.5730 -2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2100 2.5910 -2.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0870 3.1910 -5.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7760 -2.1150 -4.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2520 -3.5210 -6.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 -2.9070 -8.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 -0.8790 -9.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6310 2.1930 -8.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1070 2.8130 -7.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1000 4.2800 -7.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7950 4.0720 -9.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8020 2.6050 -9.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7120 3.9150 -8.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7050 5.3820 -8.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4000 5.1740 -11.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4070 3.7070 -11.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7340 5.6970 -11.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3170 5.0170 -10.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3100 6.4840 -10.1780 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 1 0 0 0 0 2 32 1 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 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 10 2 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 11 12 2 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 23 24 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 28 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 M END