RDKit 3D 102108 0 0 0 0 0 0 0 0999 V2000 8.7860 2.6252 -1.9778 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3914 1.5351 -1.8274 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6360 0.4179 -1.6034 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2516 0.3171 -1.5098 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7252 1.1268 -0.3707 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3649 1.0545 -0.1884 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9013 -0.2565 0.0040 C 0 0 2 0 0 0 0 0 0 0 0 0 3.6161 -0.1848 0.4813 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4062 -0.6161 0.0465 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3017 -0.3751 0.8713 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0127 -0.7577 0.5624 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0827 -0.4131 1.4818 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6798 -0.2530 2.7477 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4596 0.0504 3.7399 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9488 0.1943 5.0138 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7923 0.5174 6.0553 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2067 0.6483 7.3269 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1407 0.7013 5.8543 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6150 0.5495 4.5731 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9533 0.7202 4.3054 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7980 0.2266 3.5107 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2584 0.0793 2.2547 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4808 0.2374 2.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3979 -0.2539 1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9426 -0.3479 -0.0021 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5033 -0.5109 -1.1843 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.6311 0.7120 -1.8425 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0404 0.6734 -3.1350 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.6477 2.0591 -3.4319 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1263 2.1578 -4.7155 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1260 -0.3094 -3.4709 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.0200 -0.6206 -4.8494 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0487 -1.5853 -2.7012 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.9474 -2.3405 -3.0273 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9069 -1.1279 -1.1819 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.8720 -0.1676 -1.0948 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0078 -0.6003 -0.4193 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.0793 -0.7557 -1.3284 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1659 -1.3262 -0.6306 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7193 -0.3121 0.3766 C 0 0 1 0 0 0 0 0 0 0 0 0 -9.6029 -0.8226 1.6837 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7910 0.8966 0.3187 C 0 0 1 0 0 0 0 0 0 0 0 0 -9.1088 1.8385 1.2616 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3858 0.3492 0.6601 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.4683 -0.2849 1.9161 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1728 -1.4047 -0.6152 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 -1.6627 -1.4677 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1732 -1.2698 -1.1312 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1959 -1.5615 -2.0316 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8035 -1.0433 0.9577 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9252 -1.6556 1.8846 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7278 -0.1939 1.7529 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0488 0.3236 2.8430 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4133 0.8846 0.9451 C 0 0 1 0 0 0 0 0 0 0 0 0 8.7541 0.6459 0.7273 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8652 1.4586 -1.8887 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5217 0.2666 -1.7025 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8989 0.2127 -1.7598 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6149 1.3666 -2.0058 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9628 2.5506 -2.1898 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6054 2.5922 -2.1316 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8291 0.7875 -2.4489 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9823 -0.7393 -1.5064 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9426 2.2041 -0.6399 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9418 -0.7503 -0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4647 0.1416 1.8049 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1305 0.0474 5.1845 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1275 -0.1426 7.9437 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7741 0.9533 6.6837 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5781 0.9606 5.0499 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9450 -1.2271 -1.8909 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1726 0.5665 -3.8291 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4911 2.1811 -2.7095 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9388 2.8751 -3.1595 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0758 2.5107 -4.6913 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1546 0.1050 -3.3385 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5636 -0.0341 -5.4153 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9942 -2.1271 -2.7917 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4177 -1.9777 -3.7884 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0275 -2.0397 -0.6103 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8583 -1.6498 -0.0341 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9466 -1.6500 -1.3343 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7695 -2.2225 -0.1136 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7473 -0.0617 0.1077 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3793 -0.5805 2.2445 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7629 1.3137 -0.6851 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8059 2.7195 0.9627 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7224 1.2328 0.7498 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4096 0.4233 2.6198 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0985 -1.7855 -0.9347 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 -2.1801 -2.4027 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0470 -2.0383 -2.8982 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3425 -1.8603 0.4793 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5706 -0.9753 2.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5637 -0.8453 2.1354 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8843 1.2947 2.6238 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3433 1.8253 1.5464 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0570 -0.2314 1.0787 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9390 -0.6338 -1.5107 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4417 -0.7229 -1.6116 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7015 1.3534 -2.0576 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1511 3.5699 -2.2921 H 0 0 0 0 0 0 0 0 0 0 0 0 30 29 1 0 29 28 1 0 28 27 1 0 27 26 1 0 26 25 1 0 25 24 1 0 24 12 2 0 12 13 1 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 1 0 16 18 2 0 18 19 1 0 19 20 1 0 19 21 2 0 21 22 1 0 22 23 2 0 12 11 1 0 11 46 2 0 46 47 1 0 47 48 2 0 48 49 1 0 48 9 1 0 9 8 1 0 8 7 1 0 7 6 1 0 6 5 1 0 5 4 1 0 4 3 1 0 3 2 1 0 2 1 2 0 2 56 1 0 56 57 2 0 57 58 1 0 58 59 2 0 59 60 1 0 60 61 2 0 5 54 1 0 54 55 1 0 54 52 1 0 52 53 1 0 52 50 1 0 50 51 1 0 9 10 2 0 26 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 40 41 1 0 40 42 1 0 42 43 1 0 42 44 1 0 44 45 1 0 35 33 1 0 33 34 1 0 33 31 1 0 31 32 1 0 31 28 1 0 22 24 1 0 10 11 1 0 44 37 1 0 21 14 1 0 50 7 1 0 61 56 1 0 30 75 1 0 29 73 1 0 29 74 1 0 28 72 1 6 26 71 1 6 15 67 1 0 17 68 1 0 18 69 1 0 20 70 1 0 46 90 1 0 47 91 1 0 49 92 1 0 7 65 1 6 5 64 1 6 4 62 1 0 4 63 1 0 57 99 1 0 58100 1 0 59101 1 0 61102 1 0 54 97 1 1 55 98 1 0 52 95 1 1 53 96 1 0 50 93 1 6 51 94 1 0 10 66 1 0 35 80 1 1 37 81 1 1 39 82 1 0 39 83 1 0 40 84 1 6 41 85 1 0 42 86 1 6 43 87 1 0 44 88 1 1 45 89 1 0 33 78 1 1 34 79 1 0 31 76 1 6 32 77 1 0 M END