B42GIH -OEChem-04012112343D 52 55 0 0 0 0 0 0 0999 V2000 2.2526 0.5955 -0.2219 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0958 -0.2299 1.0296 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0230 0.0895 -0.2895 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2275 0.7953 1.0341 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2812 -1.0916 0.1499 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5896 -1.3917 0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1248 0.2674 0.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4710 1.3428 -0.7637 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0994 1.0709 0.3155 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1357 1.6282 -0.2202 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4295 -0.0250 1.5465 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1520 0.0929 1.1719 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3276 -0.1754 -0.9063 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2347 2.3947 0.6603 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5578 2.7571 0.3125 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5212 -2.0926 -0.4227 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1585 -2.6547 0.3344 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3727 0.4314 0.4666 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -3.3664 -0.6096 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3471 -3.6408 -0.2363 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7282 -1.2122 1.6811 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2210 -0.2611 -2.4149 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0746 -0.5113 -0.2724 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5286 1.7894 0.2232 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9487 -0.0883 -1.2737 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4028 2.2124 -0.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1128 1.2736 -1.5264 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3358 1.3294 -1.8509 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1460 2.1802 -0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3722 0.7136 2.3559 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7756 -0.9563 2.0092 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7760 0.9263 1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1703 0.2046 1.6459 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0719 0.5814 -0.6279 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7153 -1.1500 -0.5938 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4862 3.0347 1.1069 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0291 3.7216 0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5477 -1.9020 -0.7195 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1744 -2.8823 0.6337 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5778 -4.1524 -1.0504 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5806 -1.2776 2.7654 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8069 -1.2908 1.5136 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2307 -2.0803 1.2352 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1445 -0.6851 -2.8257 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0959 0.7202 -2.8828 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3973 -0.9118 -2.7283 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7491 -4.6393 -0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9703 -1.5740 -0.0806 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9800 2.5291 0.7995 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5040 -0.8190 -1.8544 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5305 3.2728 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7939 1.6031 -2.3055 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 10 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 2 11 1 0 0 0 0 3 8 1 0 0 0 0 3 12 1 0 0 0 0 3 13 1 0 0 0 0 4 7 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 16 2 0 0 0 0 6 17 2 0 0 0 0 7 9 1 0 0 0 0 8 10 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 14 2 0 0 0 0 10 15 2 0 0 0 0 11 18 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 21 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 22 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 16 19 1 0 0 0 0 16 38 1 0 0 0 0 17 20 1 0 0 0 0 17 39 1 0 0 0 0 18 23 2 0 0 0 0 18 24 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 47 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 25 1 0 0 0 0 23 48 1 0 0 0 0 24 26 2 0 0 0 0 24 49 1 0 0 0 0 25 27 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 M END $$$$