RDKit 3D 100104 0 0 0 0 0 0 0 0999 V2000 5.7435 -1.1477 1.4359 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3009 -0.5614 0.1283 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2468 0.6585 -0.0634 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6370 0.1172 -0.0809 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8526 -1.0726 0.0126 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8243 1.0112 -0.2129 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3922 0.9484 -1.6235 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5844 1.8535 -1.7357 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8368 -0.4659 -1.9541 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4541 1.3460 -2.5641 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9315 0.0645 0.2284 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5035 0.5933 -1.0894 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0331 1.4058 -1.7992 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1843 -0.0892 -1.4588 C 0 0 2 0 0 0 0 0 0 0 0 0 1.4657 0.7989 -2.2566 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6307 -0.1197 -0.0677 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6610 1.3008 0.4472 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3855 -0.8633 0.1831 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.6598 -0.9091 -0.8203 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8057 0.0589 -0.7292 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3055 0.2514 -2.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7285 -0.3938 0.2893 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4677 -0.3781 1.6103 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5264 -0.6798 2.6109 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8877 -0.3158 2.1711 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0692 -0.0862 0.6846 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.3985 -0.3841 0.4089 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1564 0.6994 0.0131 C 0 0 2 0 0 0 0 0 0 0 0 0 -8.0284 1.0913 1.0605 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.3399 0.7797 0.8213 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9491 1.6024 -0.2932 C 0 0 2 0 0 0 0 0 0 0 0 0 -11.0088 0.9245 -0.8821 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8720 1.7674 -1.3411 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.4816 1.7756 -2.5899 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9509 0.5411 -1.2236 C 0 0 1 0 0 0 0 0 0 0 0 0 -7.1562 0.4857 -2.3436 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0590 -0.9201 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3700 -0.9914 -1.5107 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1179 -2.3343 0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1972 -0.0801 2.2961 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2097 -0.8096 3.5095 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0055 -0.4738 1.5721 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0520 -0.4718 2.4144 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4458 -0.8007 2.0908 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8083 -0.8252 0.6369 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0560 -2.1862 0.1107 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5085 -0.5549 1.9304 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2128 -2.1567 1.2019 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9230 -1.4099 2.1303 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4951 -1.1642 -0.7467 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1522 1.3222 0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1047 1.1368 -1.0333 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6254 2.0522 0.0442 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6113 0.6041 0.4581 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5287 2.7397 -1.0607 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5235 1.2647 -1.5333 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6483 2.1816 -2.8014 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7386 -0.4055 -2.5757 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0480 -0.9738 -2.5487 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0810 -1.0486 -1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9186 1.5124 -3.4232 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0847 0.9091 0.9627 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3459 -1.0516 -1.9349 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5795 0.5522 -3.2161 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1520 1.9921 -0.3032 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6584 1.7407 0.6149 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1911 1.4158 1.4191 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6938 -1.9487 0.3569 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2015 -0.7680 -1.8296 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1556 -1.9252 -0.9145 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3328 1.0629 -0.4871 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5239 1.2073 -2.1889 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2842 -0.0385 3.5122 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4566 -1.7184 3.0218 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2573 0.6281 2.6753 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5986 -1.0953 2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8130 0.9831 0.5185 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4683 1.5748 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5802 -0.2693 0.6593 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8995 1.0859 1.7541 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3177 2.5760 0.0782 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8612 1.3278 -0.6118 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3331 2.6987 -1.1381 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3176 2.3333 -2.5425 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6400 -0.3317 -1.1415 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4465 -0.2387 -2.9825 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3618 -1.5395 -1.5789 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6576 -1.6519 -2.0247 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5601 -0.0217 -1.9828 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3712 -3.0253 -0.3384 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1359 -2.6924 0.8658 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9414 -2.4770 1.2325 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2039 0.9882 2.6071 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2958 -0.2272 4.2988 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8684 -0.1976 3.4691 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0775 -0.0174 2.5825 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6259 -1.8161 2.5009 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0685 -2.3611 -0.2386 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9375 -2.8890 1.0006 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3231 -2.5907 -0.6145 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 4 6 1 0 6 7 1 0 7 8 1 0 7 9 1 0 7 10 1 0 2 11 1 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 1 0 14 16 1 0 16 17 1 1 16 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 20 22 1 0 22 23 2 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 31 32 1 0 31 33 1 0 33 34 1 0 33 35 1 0 35 36 1 0 26 37 1 0 37 38 1 0 37 39 1 0 23 40 1 0 40 41 1 0 40 42 1 0 42 43 2 0 43 44 1 0 44 45 1 0 45 46 1 6 45 11 1 0 45 16 1 0 42 18 1 0 37 22 1 0 35 28 1 0 1 47 1 0 1 48 1 0 1 49 1 0 2 50 1 6 3 51 1 0 3 52 1 0 6 53 1 0 6 54 1 0 8 55 1 0 8 56 1 0 8 57 1 0 9 58 1 0 9 59 1 0 9 60 1 0 10 61 1 0 11 62 1 1 14 63 1 6 15 64 1 0 17 65 1 0 17 66 1 0 17 67 1 0 18 68 1 1 19 69 1 0 19 70 1 0 20 71 1 1 21 72 1 0 24 73 1 0 24 74 1 0 25 75 1 0 25 76 1 0 26 77 1 1 28 78 1 6 30 79 1 0 30 80 1 0 31 81 1 1 32 82 1 0 33 83 1 1 34 84 1 0 35 85 1 1 36 86 1 0 38 87 1 0 38 88 1 0 38 89 1 0 39 90 1 0 39 91 1 0 39 92 1 0 40 93 1 1 41 94 1 0 43 95 1 0 44 96 1 0 44 97 1 0 46 98 1 0 46 99 1 0 46100 1 0 M END