RDKit 3D 98 97 0 0 0 0 0 0 0 0999 V2000 10.2450 2.3397 -0.9027 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3358 3.1310 -0.8906 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2513 4.0964 -0.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9479 3.5286 -1.3468 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5062 2.3910 -0.4569 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2216 1.8043 -0.8827 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6567 2.2391 -1.8566 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5988 0.6781 -0.1334 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5872 -0.5697 -0.8917 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3415 -0.5203 -1.9599 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9323 -1.7744 -0.6935 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2115 -2.8175 -1.7337 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0197 -2.2144 0.3351 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7913 -1.4275 0.2536 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7402 -0.6885 -0.8047 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6989 -1.3561 1.1166 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6579 -2.0871 2.3833 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5052 -0.5702 0.8049 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.2359 -1.0379 -0.3704 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4911 -1.3563 -1.3904 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6064 -1.2104 -0.6044 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9015 -1.5974 -2.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7445 -1.1817 0.2221 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.1124 0.0146 0.9513 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7402 0.0548 2.1812 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8376 1.1480 0.4797 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0878 2.2220 1.4148 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3034 1.2432 -0.8728 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.8650 2.4293 -1.6148 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1288 3.5268 -1.1365 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1917 2.4767 -2.8567 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8233 1.0941 -0.9721 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.6068 2.1168 -0.2425 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2043 1.0234 -2.4137 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9715 -2.4467 1.0568 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.8977 -2.8063 2.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2405 -3.6370 0.1509 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1145 0.8876 0.6673 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.3344 1.6995 0.3452 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 1.3988 2.0014 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6652 -2.4336 1.6377 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7907 -3.4775 1.3707 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2014 -1.3468 2.4384 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0442 1.6460 -0.9182 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1723 4.5711 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5246 4.9302 -1.5969 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1937 4.3508 -1.2878 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0803 3.1344 -2.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2666 1.5716 -0.5283 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4907 2.7000 0.6164 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6006 0.9332 0.2583 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2473 0.5331 0.7665 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2487 -2.7277 -2.0799 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0990 -3.8283 -1.3104 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5048 -2.7160 -2.5714 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6586 -3.2944 0.0499 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3891 -1.6221 3.0614 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6974 -3.1650 2.2595 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3320 -1.9029 2.9119 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1739 -0.6353 1.6692 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8064 -2.2323 -2.0718 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0749 -2.1692 -2.4574 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1126 -0.6856 -2.6235 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6630 -1.3213 -0.5174 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3315 2.1234 2.2645 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0610 2.0801 1.9317 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9942 3.2297 1.0223 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9466 0.3432 -1.4656 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6045 4.4535 -0.9663 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1134 3.5112 -0.9315 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0032 0.0503 -0.5593 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0264 1.6465 0.6952 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5487 2.3904 -0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1099 3.0461 0.0186 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4009 0.5020 -2.9984 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4584 1.9913 -2.8808 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1169 0.3694 -2.5554 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9199 -2.3259 1.6591 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1107 -3.7969 2.5052 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7178 -2.0243 2.7865 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9311 -2.9689 1.4865 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3726 -3.9371 -0.4362 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1090 -3.4934 -0.4957 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4798 -4.4948 0.8308 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6229 1.1006 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0539 2.7290 -0.0321 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9413 1.2633 -0.4725 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9592 1.9043 1.2393 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7064 2.4580 1.8374 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2737 0.7810 2.3078 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4526 1.3283 2.7064 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0089 -3.0635 2.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4176 -3.0208 0.6002 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3261 -4.4268 1.0785 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3374 -3.5323 2.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3126 -1.2781 2.2735 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1505 -1.6261 3.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6860 -0.3696 2.3584 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 3 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 6 8 1 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 16 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 21 22 1 0 21 23 1 0 23 24 1 0 24 25 2 0 24 26 1 0 26 27 1 0 26 28 1 0 28 29 1 0 29 30 1 0 29 31 2 0 28 32 1 0 32 33 1 0 32 34 1 0 23 35 1 0 35 36 1 0 35 37 1 0 18 38 1 0 38 39 1 0 38 40 1 0 13 41 1 0 41 42 1 0 41 43 1 0 1 44 1 0 3 45 1 0 3 46 1 0 4 47 1 0 4 48 1 0 5 49 1 0 5 50 1 0 8 51 1 0 8 52 1 0 12 53 1 0 12 54 1 0 12 55 1 0 13 56 1 6 17 57 1 0 17 58 1 0 17 59 1 0 18 60 1 1 22 61 1 0 22 62 1 0 22 63 1 0 23 64 1 6 27 65 1 0 27 66 1 0 27 67 1 0 28 68 1 6 30 69 1 0 30 70 1 0 32 71 1 1 33 72 1 0 33 73 1 0 33 74 1 0 34 75 1 0 34 76 1 0 34 77 1 0 35 78 1 1 36 79 1 0 36 80 1 0 36 81 1 0 37 82 1 0 37 83 1 0 37 84 1 0 38 85 1 6 39 86 1 0 39 87 1 0 39 88 1 0 40 89 1 0 40 90 1 0 40 91 1 0 41 92 1 1 42 93 1 0 42 94 1 0 42 95 1 0 43 96 1 0 43 97 1 0 43 98 1 0 M END