RDKit 3D 48 52 0 0 0 0 0 0 0 0999 V2000 4.6004 1.6890 -1.0214 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4959 1.9681 0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0598 0.6593 0.5445 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0221 0.7119 1.5250 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3176 -0.5798 1.4980 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1497 -0.4290 1.4726 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8045 -0.2108 0.1764 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3540 1.1576 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7537 2.2838 -0.0019 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7567 1.1092 -0.2757 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5706 2.1851 -0.5333 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5633 3.0739 0.5374 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1421 -0.2365 -0.2086 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4274 -0.7592 -0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6450 -2.1157 -0.2553 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5511 -2.9204 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2814 -2.4036 0.1842 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0628 -1.0361 0.0668 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0307 -0.5580 -1.0277 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2792 0.2445 -1.1849 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4888 -0.2856 -0.4913 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9762 -1.3787 0.4621 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2277 -2.4049 -0.2674 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2007 -1.9193 -1.0561 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1699 1.0201 -1.7938 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0301 2.5975 -1.4401 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3758 1.0818 -0.4783 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8782 2.5948 0.8245 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7022 2.5013 -0.5132 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9497 0.1104 0.9781 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4038 1.5210 1.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5830 -1.0366 2.5019 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4143 0.4342 2.1521 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6031 -1.3196 1.9858 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9898 3.9908 0.3355 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6109 3.3341 0.7704 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1521 2.5405 1.4233 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2744 -0.1298 -0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6172 -2.5789 -0.3704 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6673 -4.0093 0.1272 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4776 -3.1063 0.4044 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6172 -0.3076 -1.9221 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5291 0.2785 -2.2883 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1295 1.2745 -0.8586 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2551 -0.6942 -1.1621 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9159 -1.8442 0.8727 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9139 -3.2041 0.4095 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9506 -2.8937 -0.9875 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 7 8 1 6 8 9 2 0 8 10 1 0 10 11 1 0 11 12 1 0 10 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 21 3 1 0 18 13 1 0 22 5 1 0 18 7 1 0 24 19 1 0 1 25 1 0 1 26 1 0 1 27 1 0 2 28 1 0 2 29 1 0 3 30 1 1 4 31 1 0 5 32 1 1 6 33 1 0 6 34 1 0 19 42 1 6 20 43 1 0 20 44 1 0 21 45 1 6 22 46 1 1 23 47 1 0 23 48 1 0 12 35 1 0 12 36 1 0 12 37 1 0 14 38 1 0 15 39 1 0 16 40 1 0 17 41 1 0 M END