RDKit 3D 108112 0 0 0 0 0 0 0 0999 V2000 -8.4985 -2.1612 -0.9894 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6223 -1.4853 -1.4233 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7679 -0.1493 -1.6969 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7552 0.7783 -1.5498 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9379 2.1034 -1.8403 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0084 3.1860 -1.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9607 3.3841 -0.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1827 2.7106 -0.0149 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1001 3.2884 0.4688 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3668 1.4762 0.5307 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4496 0.9441 1.5140 C 0 0 1 0 0 0 0 0 0 0 0 0 -6.3434 0.8230 2.7613 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.6383 0.8685 3.9342 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0616 -0.4508 2.4714 C 0 0 1 0 0 0 0 0 0 0 0 0 -8.5201 -0.0731 2.1759 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0889 0.4530 3.3303 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5423 -0.9708 1.2643 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2139 -0.4814 1.1970 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.4461 -1.2672 2.2135 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5163 -2.6275 1.8547 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7624 -0.6661 -0.0950 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4797 -0.2572 -0.3165 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.7441 -1.3753 -0.7085 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3911 -1.2433 -0.6618 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8119 -1.6046 0.6964 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6103 -1.4360 0.6481 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3865 -1.7277 1.7642 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7621 -2.1375 2.7782 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8238 -1.5812 1.7922 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5247 -1.1496 0.7631 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9678 -0.9909 0.7559 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5830 -0.4976 -0.3898 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9726 -0.3314 -0.4459 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7690 -0.6477 0.6199 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1261 -0.5071 0.6252 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9188 -0.0051 -0.4179 C 0 0 2 0 0 0 0 0 0 0 0 0 10.7976 -1.0464 -0.7845 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4180 -0.5671 -1.9620 C 0 0 2 0 0 0 0 0 0 0 0 0 12.0835 -1.7240 -2.6357 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1509 -2.7178 -2.9720 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4568 0.4571 -1.5841 C 0 0 1 0 0 0 0 0 0 0 0 0 12.8768 1.0876 -2.7526 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9450 1.4889 -0.6374 C 0 0 2 0 0 0 0 0 0 0 0 0 13.0077 1.8132 0.2389 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7761 1.0923 0.1921 C 0 0 1 0 0 0 0 0 0 0 0 0 9.9131 2.1941 0.3752 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1566 -1.1373 1.7555 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9600 -1.4613 2.8421 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3555 -1.9618 4.0078 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7690 -1.3052 1.8178 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8769 0.0514 -1.1583 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0109 -0.1307 -2.2764 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8389 1.1398 -1.4440 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5826 1.6298 -2.7456 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2988 0.7393 -1.4412 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.5427 0.1409 -2.6780 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.2268 2.4487 -2.2984 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2450 1.5434 -2.4503 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0353 0.2281 -2.1519 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0510 -0.7052 -2.2967 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3138 -3.1160 -1.5756 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5543 -1.5729 -1.1828 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4720 -2.4695 0.0582 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7811 0.4367 -1.2234 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2991 4.0744 -2.3569 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5318 4.4571 -1.1629 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6028 1.5890 1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0171 1.7243 2.7733 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7467 1.2943 3.7345 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0445 -1.1871 3.2831 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0844 -0.9175 1.7734 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4633 0.7410 1.4244 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7438 -0.1585 3.7615 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0185 -1.2223 3.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4439 -0.9161 2.4358 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6503 -2.9543 1.4909 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9667 0.1696 0.5691 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9825 -2.0383 -1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9875 -2.6707 0.9427 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2565 -0.9843 1.4871 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3623 -1.8388 2.7085 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9523 -0.8998 -0.1399 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0038 -0.2308 -1.2631 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3827 0.0563 -1.3666 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3524 0.3500 -1.2946 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6228 -0.1286 -2.6017 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8302 -2.1709 -1.9686 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5917 -1.4332 -3.5695 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5583 -2.2844 -3.6609 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3329 -0.0750 -1.1397 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5338 2.0122 -2.7671 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7042 2.4380 -1.1707 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9410 1.2793 1.0717 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0841 0.7193 1.1875 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6667 2.2570 1.3501 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1791 -2.2899 4.6887 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7873 -2.8838 3.7672 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7596 -1.2057 4.5267 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3530 -1.6937 2.7371 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1528 0.4722 -0.3797 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2113 0.7506 -2.6714 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6768 2.0429 -0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5818 2.5977 -2.8036 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8995 1.6383 -1.3695 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5011 0.8595 -3.3612 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4675 3.4694 -2.5515 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2363 1.8491 -2.8091 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9250 -1.6770 -2.0856 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 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 12 14 1 0 14 15 1 0 15 16 1 0 14 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 18 21 1 6 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 2 0 27 29 1 0 29 30 2 0 30 31 1 0 31 32 2 0 32 33 1 0 33 34 2 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 39 40 1 0 38 41 1 0 41 42 1 0 41 43 1 0 43 44 1 0 43 45 1 0 45 46 1 0 34 47 1 0 47 48 1 0 48 49 1 0 47 50 2 0 24 51 1 0 51 52 1 0 51 53 1 0 53 54 1 0 53 55 1 0 55 56 1 0 5 57 2 0 57 58 1 0 58 59 2 0 59 60 1 0 59 3 1 0 18 11 1 0 55 22 1 0 50 31 1 0 45 36 1 0 1 61 1 0 1 62 1 0 1 63 1 0 4 64 1 0 6 65 1 0 7 66 1 0 11 67 1 1 12 68 1 1 13 69 1 0 14 70 1 1 15 71 1 0 15 72 1 0 16 73 1 0 19 74 1 0 19 75 1 0 20 76 1 0 22 77 1 1 24 78 1 6 25 79 1 0 25 80 1 0 29 81 1 0 30 82 1 0 32 83 1 0 33 84 1 0 36 85 1 6 38 86 1 6 39 87 1 0 39 88 1 0 40 89 1 0 41 90 1 1 42 91 1 0 43 92 1 6 44 93 1 0 45 94 1 1 46 95 1 0 49 96 1 0 49 97 1 0 49 98 1 0 50 99 1 0 51100 1 1 52101 1 0 53102 1 1 54103 1 0 55104 1 1 56105 1 0 57106 1 0 58107 1 0 60108 1 0 M END