RDKit 3D 84 86 0 0 0 0 0 0 0 0999 V2000 8.3971 3.3846 2.1572 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0710 2.9836 1.4615 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8686 3.0190 0.1968 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8625 2.4382 -0.6481 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7324 3.5912 -0.4246 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4006 3.5128 0.1406 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8581 2.1097 0.1261 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4690 2.1459 0.7367 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8566 0.7426 0.7543 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7492 0.2113 -0.5839 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1058 -0.8346 -0.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1373 -1.1659 -2.2699 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3526 -1.7033 -0.0082 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7852 -3.1229 0.0525 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1794 -3.7432 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9928 -2.8565 -1.4554 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9401 -1.8437 -0.4249 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1473 -1.1165 0.1182 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0783 -0.2564 0.9965 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5316 -1.3529 -0.3320 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.0833 -2.5863 0.4005 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4962 -2.8109 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1046 -3.9875 0.5826 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9995 -5.2541 0.0487 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5831 -6.3492 0.6931 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2667 -6.1447 1.8726 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8509 -7.2171 2.5245 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3831 -4.8927 2.4209 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7939 -3.8259 1.7591 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3225 -0.1897 0.0785 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1698 0.3731 -0.6779 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3904 -0.0994 -1.9585 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9333 1.5415 -0.2027 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.3046 1.2259 -0.2529 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6888 2.7616 -1.0765 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 3.8640 -0.4965 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8096 4.0925 -0.8987 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5547 5.1151 -0.3535 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0119 5.9528 0.6255 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7819 6.9763 1.1601 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7112 5.7003 1.0065 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9609 4.6749 0.4612 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8215 -0.1031 1.4986 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0789 0.1646 2.6973 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4657 -1.1910 0.9344 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7618 2.9293 -0.7863 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6327 1.5161 -1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8620 4.0867 -1.3216 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5146 3.8062 1.2201 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7368 4.2528 -0.3423 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8573 1.7532 -0.9074 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5543 1.4839 0.7205 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5839 2.4781 1.7874 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8569 2.8512 0.1739 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8817 0.8434 1.2654 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0140 -1.0602 -2.7812 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 -1.2162 1.0013 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3099 -3.5770 0.9666 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8630 -3.2860 0.1652 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9493 -3.7174 -1.9722 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8922 -4.8039 -1.0069 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1143 -3.5112 -1.5126 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1827 -2.4115 -2.4599 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6422 -1.4466 -1.4227 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4700 -3.4501 0.1868 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0516 -2.3606 1.4889 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1101 -1.9008 0.0312 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4285 -2.9980 -1.1875 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4734 -5.4375 -0.8669 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5180 -7.3454 0.3028 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7954 -7.5353 2.3632 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9216 -4.7302 3.3509 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8883 -2.8448 2.1943 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3320 -0.4398 -2.1611 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7159 1.8092 0.8412 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4103 0.4537 0.3628 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6426 3.0711 -1.0409 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9928 2.5515 -2.1235 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2377 3.4503 -1.6549 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5823 5.3279 -0.6425 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7575 7.8949 0.7073 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2818 6.3485 1.7687 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9418 4.5130 0.7902 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4532 -1.2828 -0.0912 H 0 0 0 0 0 0 0 0 0 0 0 0 4 3 1 0 3 2 2 0 3 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 11 12 1 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 26 28 1 0 28 29 2 0 20 30 1 0 30 31 2 0 31 32 1 0 31 33 1 0 33 34 1 0 33 35 1 0 35 36 1 0 36 37 2 0 37 38 1 0 38 39 2 0 39 40 1 0 39 41 1 0 41 42 2 0 9 43 1 0 43 45 1 0 43 44 2 0 17 13 1 0 29 23 1 0 42 36 1 0 4 46 1 0 4 47 1 0 2 1 1 0 5 48 1 0 6 49 1 0 6 50 1 0 7 51 1 0 7 52 1 0 8 53 1 0 8 54 1 0 9 55 1 1 12 56 1 0 13 57 1 1 14 58 1 0 14 59 1 0 15 60 1 0 15 61 1 0 16 62 1 0 16 63 1 0 20 64 1 6 21 65 1 0 21 66 1 0 22 67 1 0 22 68 1 0 24 69 1 0 25 70 1 0 27 71 1 0 28 72 1 0 29 73 1 0 32 74 1 0 33 75 1 1 34 76 1 0 35 77 1 0 35 78 1 0 37 79 1 0 38 80 1 0 40 81 1 0 41 82 1 0 42 83 1 0 45 84 1 0 M END