RDKit 3D 49 52 0 0 0 0 0 0 0 0999 V2000 -6.4944 0.9562 1.0852 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2250 0.2235 1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2851 -0.9004 1.9286 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8923 0.7672 1.1246 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3772 0.4225 -0.2825 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0980 1.0127 -0.3573 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9103 0.3462 -0.2984 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 0.9631 -0.1884 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4899 0.2613 -0.1315 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7946 0.9600 -0.0127 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9195 0.3071 0.0427 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1861 0.9973 0.1586 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3802 0.2607 0.2171 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6072 0.8738 0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6960 2.2457 0.3851 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9028 2.9124 0.4964 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5415 3.0024 0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5973 4.3741 0.3846 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3195 2.3581 0.2184 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4233 -1.0279 -0.1847 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2724 -1.7090 -0.2919 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3286 -2.9484 -0.3335 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9299 -1.0566 -0.3529 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1723 -1.7801 -0.4635 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2139 -3.1470 -0.6096 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4397 -3.7390 -0.7955 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5078 -5.1164 -0.9449 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6172 -3.0151 -0.8404 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8373 -3.6352 -1.0297 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5805 -1.6539 -0.6944 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3568 -1.0283 -0.5029 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0018 0.5423 0.2068 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1785 0.7789 1.9569 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3332 2.0296 0.9662 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9579 1.8827 1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1191 0.4814 1.8716 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0346 0.8987 -1.0332 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 2.0444 -0.1442 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7751 2.0269 0.0258 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9034 -0.7975 -0.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3279 -0.8182 0.1732 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5401 0.3132 0.3743 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9779 3.9140 0.5367 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7415 4.9037 0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4551 3.0003 0.1798 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3563 -3.7695 -0.5903 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7283 -5.7307 -0.9292 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6851 -3.1087 -1.0668 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5207 -1.0785 -0.7438 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 15 17 1 0 17 18 1 0 17 19 2 0 9 20 1 0 20 21 1 0 21 22 2 0 21 23 1 0 23 24 1 0 24 25 2 0 25 26 1 0 26 27 1 0 26 28 2 0 28 29 1 0 28 30 1 0 30 31 2 0 31 5 1 0 23 7 2 0 31 24 1 0 19 12 1 0 1 32 1 0 1 33 1 0 1 34 1 0 4 35 1 0 4 36 1 0 5 37 1 6 8 38 1 0 10 39 1 0 11 40 1 0 13 41 1 0 14 42 1 0 16 43 1 0 18 44 1 0 19 45 1 0 25 46 1 0 27 47 1 0 29 48 1 0 30 49 1 0 M END