RDKit 3D 98104 0 0 0 0 0 0 0 0999 V2000 -0.5677 -5.3082 1.1097 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7502 -3.8808 1.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4781 -2.8844 0.9638 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5773 -2.0707 -0.0195 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3925 -2.7217 -1.3490 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.8877 -4.0233 -1.3313 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0044 -2.7826 -1.8788 C 0 0 2 0 0 0 0 0 0 0 0 0 1.6264 -3.8843 -1.2847 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0059 -4.8363 -2.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8258 -1.5866 -1.5383 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0637 -1.6846 -2.1383 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 -0.2509 -1.7941 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4713 0.1789 -0.5445 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5291 -1.0290 0.2936 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9076 -1.5908 -0.0277 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8495 -0.6394 0.3535 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9097 -0.8673 1.2097 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0294 -2.0233 1.6792 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8738 0.1463 1.5853 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8330 1.4445 1.1245 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7850 2.3631 1.5213 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8131 2.0237 2.3916 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7725 2.9406 2.7943 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7991 4.2704 2.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8449 0.7310 2.8439 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8898 -0.1922 2.4464 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8771 0.8328 -0.6909 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.4759 1.0944 0.6786 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.8723 -0.2814 1.1682 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.1424 -0.4000 1.6755 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2009 -1.0101 2.9365 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8391 -1.1998 -0.0653 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.9027 -0.1948 -1.1428 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.2255 0.3412 -1.2459 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1158 -0.3653 -2.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0217 -1.3394 -1.3811 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7165 1.2770 -0.3494 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6885 1.9466 0.5274 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.2962 2.4286 1.8257 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4367 3.2311 1.5560 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9948 3.6738 2.7553 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3420 3.2607 -0.2059 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.5589 3.9676 -0.2684 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9625 2.9124 -1.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7381 1.9657 -1.6063 C 0 0 1 0 0 0 0 0 0 0 0 0 0.4023 2.7148 -1.5032 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 3.0483 -2.6407 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3612 -5.4498 0.5599 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4501 -6.0122 2.0085 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4894 -5.6998 0.6385 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0526 -3.9148 2.5772 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7469 -3.9760 2.1871 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9998 -2.2627 -2.1772 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0056 -4.3537 -2.2514 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 -2.9497 -2.9828 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4864 -5.6655 -1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1495 -5.2776 -2.7574 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7525 -4.3795 -2.8843 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5872 -0.8660 -1.8904 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0395 0.4362 -1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5653 -0.2114 -2.7099 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 0.9420 -0.0157 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5895 -0.8159 1.3598 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0574 -2.5893 0.4082 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0473 1.7495 0.4448 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7674 3.3952 1.1656 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7069 4.3725 1.2696 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0499 4.9131 2.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7934 4.6943 2.6308 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6361 0.4498 3.5203 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9960 -1.1900 2.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 1.5612 1.3772 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2186 -0.6872 1.9662 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3004 -1.0209 3.2003 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6873 -0.4143 3.6909 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9155 -2.0769 2.9213 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7448 -1.8271 -0.1491 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6230 -0.4665 -2.1525 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7865 0.3805 -2.5896 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5390 -0.8349 -2.9064 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6241 -2.3661 -1.5517 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1213 -1.1936 -0.3081 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0461 -1.3487 -1.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3126 2.0589 -0.9146 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5074 0.8592 0.3212 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6473 1.6727 2.5097 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5705 3.1461 2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8871 4.3031 2.5822 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2365 4.3181 3.2505 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2016 2.8427 3.4525 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6543 3.8756 0.3607 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4114 4.7367 -0.8566 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7843 2.4695 -2.1579 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6529 3.8277 -2.1359 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7848 1.6110 -2.6578 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9900 3.6119 -2.4999 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2633 2.1703 -3.2531 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4349 3.7058 -3.3225 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 4 3 1 1 4 14 1 0 14 13 1 0 13 12 1 0 12 10 1 0 10 11 1 6 10 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 17 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 1 0 22 25 1 0 25 26 2 0 10 7 1 0 7 8 1 0 8 9 1 0 7 5 1 0 5 6 1 0 13 27 1 0 27 33 1 0 33 32 1 0 32 29 1 0 29 30 1 0 30 31 1 0 29 28 1 0 28 38 1 0 38 39 1 1 39 40 1 0 40 41 1 0 38 37 1 0 37 34 1 0 34 35 1 0 35 36 1 0 38 42 1 0 42 43 1 0 42 44 1 0 44 45 1 0 45 46 1 0 46 47 1 0 5 4 1 0 28 27 1 0 32 4 1 0 15 14 1 0 26 19 1 0 27 45 1 6 34 33 1 0 1 48 1 0 1 49 1 0 1 50 1 0 2 51 1 0 2 52 1 0 14 63 1 1 13 62 1 1 12 60 1 0 12 61 1 0 11 59 1 0 15 64 1 1 20 65 1 0 21 66 1 0 24 67 1 0 24 68 1 0 24 69 1 0 25 70 1 0 26 71 1 0 7 55 1 6 9 56 1 0 9 57 1 0 9 58 1 0 5 53 1 6 6 54 1 0 33 78 1 6 32 77 1 1 29 73 1 1 31 74 1 0 31 75 1 0 31 76 1 0 28 72 1 1 39 86 1 0 39 87 1 0 41 88 1 0 41 89 1 0 41 90 1 0 37 84 1 0 37 85 1 0 35 79 1 0 35 80 1 0 36 81 1 0 36 82 1 0 36 83 1 0 42 91 1 1 43 92 1 0 44 93 1 0 44 94 1 0 45 95 1 6 47 96 1 0 47 97 1 0 47 98 1 0 M END