RDKit 3D 86 85 0 0 0 0 0 0 0 0999 V2000 -2.2132 1.2689 -2.2697 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3957 1.1930 -1.3700 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0407 1.6954 -0.1233 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9808 -0.1930 -1.2902 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.9884 -1.0875 -0.7103 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5684 -2.1763 -1.5121 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0689 -2.2699 -2.7004 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6343 -3.1875 -1.0856 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5110 -4.2547 -2.0436 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 -2.6768 -0.8056 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5836 -3.8862 -0.4278 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0013 -3.7097 -0.0648 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2068 -2.9011 1.0859 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1238 -3.5498 2.3213 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4806 -1.5387 1.0986 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5983 -0.9277 2.2569 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6498 -0.7269 -0.1138 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1884 -0.6564 -0.3889 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8900 -0.2041 0.6082 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6390 0.2719 1.6867 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7171 -0.1681 2.8718 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5118 1.4885 1.4792 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0547 1.9951 2.7115 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6924 0.9812 0.6432 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6177 2.1383 0.4275 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8191 1.8125 -0.3822 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6270 3.0011 -0.4709 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5835 3.2271 0.4348 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4149 3.9278 -1.5108 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1279 4.9682 -1.6479 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1716 -0.2047 -0.3644 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0337 -0.1975 0.8795 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4764 -0.2268 -0.8977 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6266 -0.2963 -2.2551 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6764 -0.1399 -0.1087 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1173 1.3055 0.0238 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3787 1.4828 0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3447 1.0608 2.2275 C 0 0 2 0 0 0 0 0 0 0 0 0 -10.6952 1.3036 2.7676 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3617 1.8158 3.0561 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8120 2.5570 3.9932 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0340 1.7232 2.8295 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0043 0.2849 -2.7594 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2945 1.5601 -1.7249 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3466 2.0547 -3.0585 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1899 1.8745 -1.7796 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3836 1.1461 0.3609 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2990 -0.5321 -2.2879 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6332 -0.9099 0.2399 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0165 -3.6582 -0.1079 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4265 -4.5258 -2.4032 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7498 -4.1390 -2.7239 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1957 -2.2386 -1.7563 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2057 -1.8800 -0.0508 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5326 -4.6623 -1.2411 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0064 -4.3906 0.4133 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5458 -4.6992 0.0196 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5498 -3.2204 -0.9457 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4043 -4.2389 2.2129 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3513 0.3512 0.0851 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1026 -1.0257 -0.9845 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3899 -1.7052 -0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2608 -0.0310 -1.3809 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5584 -1.3028 1.3701 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0306 2.2844 0.9277 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2659 2.4078 3.2868 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5050 1.2743 3.3207 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1460 0.1057 1.1373 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2598 0.6111 -0.3161 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0059 2.9476 -0.0289 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9798 2.4919 1.4203 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3562 0.9746 0.1503 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5131 1.4644 -1.3926 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8855 4.1579 0.3484 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6155 3.7391 -2.2129 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2105 -1.1295 -2.6095 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4912 -0.7939 -0.4505 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4460 -0.4542 0.9581 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3009 1.9074 0.5141 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2653 1.7735 -0.9802 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6525 2.5817 0.7367 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2064 0.9178 0.3009 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1599 -0.0148 2.3266 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2679 1.8532 2.0907 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6612 1.8129 3.6812 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4255 0.9369 2.8938 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 6 8 1 0 8 9 1 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 13 15 1 0 15 16 2 0 15 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 2 0 20 22 1 0 22 23 1 0 22 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 27 29 1 0 29 30 2 0 4 31 1 0 31 32 2 0 31 33 1 0 33 34 1 0 33 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 38 40 1 0 40 41 2 0 40 42 1 0 1 43 1 0 1 44 1 0 1 45 1 0 2 46 1 6 3 47 1 0 4 48 1 6 5 49 1 0 8 50 1 1 9 51 1 0 9 52 1 0 10 53 1 0 10 54 1 0 11 55 1 0 11 56 1 0 12 57 1 0 12 58 1 0 14 59 1 0 17 60 1 0 17 61 1 0 18 62 1 0 18 63 1 0 19 64 1 0 22 65 1 6 23 66 1 0 23 67 1 0 24 68 1 0 24 69 1 0 25 70 1 0 25 71 1 0 26 72 1 0 26 73 1 0 28 74 1 0 29 75 1 0 34 76 1 0 35 77 1 0 35 78 1 0 36 79 1 0 36 80 1 0 37 81 1 0 37 82 1 0 38 83 1 6 39 84 1 0 39 85 1 0 42 86 1 0 M END