RDKit 3D 107109 0 0 0 0 0 0 0 0999 V2000 -6.7510 -0.7975 -5.8502 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3188 0.2004 -4.9107 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4582 -0.1321 -3.8876 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0794 -1.3373 -3.8314 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9797 0.8829 -2.8797 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.1164 1.5491 -2.1762 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9999 0.6556 -1.4133 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1035 0.0281 -1.9845 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9340 -0.7892 -1.2653 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6490 -0.9948 0.1056 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4909 -1.8219 0.8112 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.3718 -2.0772 2.1742 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6411 -0.8422 2.9423 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6549 -0.8487 3.8182 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9879 0.3686 4.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4783 -2.0748 4.0153 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5553 -0.3703 0.6553 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7316 0.4495 -0.0874 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0472 0.1798 -2.0405 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7024 0.6071 -1.8535 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3667 1.6741 -2.4408 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7063 -0.1116 -1.0423 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4433 -1.4874 -1.8083 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4638 0.5824 -1.0211 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7157 0.2076 -0.3133 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6853 -0.8382 0.3599 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9672 1.0490 -0.3919 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2630 1.6453 0.9029 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3211 2.5181 1.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 1.9283 2.4405 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5243 2.6326 3.1337 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6135 4.0058 2.9962 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5643 4.7422 3.6999 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2930 4.6092 2.1222 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2276 3.8702 1.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0852 0.0859 -0.6611 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5861 -0.0571 -1.9607 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0177 0.7198 -2.8372 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6096 -0.9200 -2.4934 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3018 -1.7874 -1.5787 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1324 -1.2246 -0.5269 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2910 -0.0110 -0.3645 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8130 -2.2024 0.3679 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8325 -2.8439 1.3343 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8817 -1.6568 1.1603 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2146 -2.1027 0.9102 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3543 -2.9726 -0.0307 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4054 -1.6398 1.6483 C 0 0 1 0 0 0 0 0 0 0 0 0 11.5230 -2.3137 1.1327 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6274 -0.1718 1.5885 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8197 0.3908 0.2437 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0673 0.3890 -0.3312 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2415 0.9531 -1.5744 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1892 1.5227 -2.2584 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9333 1.5395 -1.7106 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7821 0.9665 -0.4621 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4305 -0.4431 -6.8461 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2074 -1.7643 -5.6216 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8179 -1.0199 -5.7498 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3963 1.7113 -3.3803 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7718 2.0904 -2.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7889 2.3639 -1.4916 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3047 0.2111 -3.0488 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7970 -1.2775 -1.7187 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3185 -2.4387 2.3629 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0762 -2.8952 2.4965 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1039 0.0787 2.8677 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0644 0.8018 5.0749 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4027 1.1555 3.9533 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6745 0.0868 5.4337 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8354 -2.9293 4.3705 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2078 -1.9101 4.8413 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9681 -2.4005 3.0947 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2906 -0.5448 1.7171 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8693 0.9223 0.4104 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3690 -0.6995 -1.5288 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1141 -0.4751 -0.1092 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4233 -1.7629 -2.2127 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1535 -2.1801 -1.0115 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6748 -1.2977 -2.5719 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4063 1.4744 -1.5887 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8634 1.6239 -1.2841 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2587 2.1985 0.8824 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5057 0.8025 1.6248 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4273 0.8463 2.5963 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2143 2.1405 3.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6119 5.7479 3.5819 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 5.6900 2.0018 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9059 4.3613 0.7767 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4564 -0.4462 0.1426 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4024 -0.3964 -3.0777 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0983 -1.5544 -3.2962 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2236 -2.8164 -1.6466 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2470 -2.9645 -0.3233 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3623 -3.4512 2.0921 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2543 -2.0758 1.8839 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1718 -3.5591 0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7035 -0.9649 1.8893 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3023 -1.9704 2.7049 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2686 -2.8594 0.3487 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5449 0.0809 2.1973 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7718 0.3539 2.1202 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9047 -0.0434 0.1648 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2349 0.9600 -2.0501 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3908 1.9464 -3.2352 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1010 1.9948 -2.2568 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8003 0.9719 -0.0166 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 3 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 2 3 14 15 1 0 14 16 1 0 10 17 1 0 17 18 2 0 5 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 2 0 25 27 1 0 27 28 1 0 28 29 1 0 29 30 2 0 30 31 1 0 31 32 2 0 32 33 1 0 32 34 1 0 34 35 2 0 27 36 1 0 36 37 1 0 37 38 2 0 37 39 1 0 39 40 1 0 40 41 1 0 41 42 2 0 41 43 1 0 43 44 1 0 43 45 1 0 45 46 1 0 46 47 2 0 46 48 1 0 48 49 1 0 48 50 1 0 50 51 1 0 51 52 2 0 52 53 1 0 53 54 2 0 54 55 1 0 55 56 2 0 18 7 1 0 35 29 1 0 56 51 1 0 1 57 1 0 1 58 1 0 1 59 1 0 5 60 1 6 6 61 1 0 6 62 1 0 8 63 1 0 9 64 1 0 12 65 1 0 12 66 1 0 13 67 1 0 15 68 1 0 15 69 1 0 15 70 1 0 16 71 1 0 16 72 1 0 16 73 1 0 17 74 1 0 18 75 1 0 19 76 1 0 22 77 1 1 23 78 1 0 23 79 1 0 23 80 1 0 24 81 1 0 27 82 1 6 28 83 1 0 28 84 1 0 30 85 1 0 31 86 1 0 33 87 1 0 34 88 1 0 35 89 1 0 36 90 1 0 39 91 1 0 39 92 1 0 40 93 1 0 43 94 1 6 44 95 1 0 44 96 1 0 44 97 1 0 45 98 1 0 48 99 1 1 49100 1 0 50101 1 0 50102 1 0 52103 1 0 53104 1 0 54105 1 0 55106 1 0 56107 1 0 M END