RDKit 3D 104106 0 0 0 0 0 0 0 0999 V2000 -3.6897 -1.5514 -2.1367 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9110 -2.0007 -0.7309 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1953 -1.1541 0.2896 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7865 -1.1664 0.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8956 -1.6693 1.0197 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4066 -2.1213 2.0726 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5325 -1.6328 0.7178 C 0 0 1 0 0 0 0 0 0 0 0 0 1.3698 -2.7493 1.2284 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0457 -4.1197 0.7839 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8538 -5.2037 1.3189 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3370 -5.2524 1.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6435 -5.2028 -0.3041 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5457 -6.5099 -0.9149 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0047 -4.2409 -1.1921 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8193 -4.6707 -2.4710 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5213 -2.9411 -1.1876 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9544 -2.0577 -0.3772 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1583 -1.9137 1.0599 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4310 -0.6959 1.5834 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5798 -0.5274 3.0584 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9480 -0.3327 3.5343 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1604 -0.3508 4.7771 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0086 -0.1295 2.6868 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7772 -1.1937 -0.6135 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2986 -1.6029 -1.7032 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6183 -2.6411 -1.6962 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6334 -1.0634 -3.0395 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.5728 -0.6867 -3.7506 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7425 0.5897 -3.7363 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8564 1.3415 -4.3569 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9527 2.7056 -4.2835 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9844 3.4143 -4.8594 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9765 2.7209 -5.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8743 1.3540 -5.6178 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8303 0.6401 -5.0349 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7681 -0.7645 -5.1339 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 1.1667 -3.0366 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3492 0.2506 -2.9945 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2761 0.4319 -1.8371 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6352 0.2707 0.2942 C 0 0 1 0 0 0 0 0 0 0 0 0 -5.1194 0.4075 0.6012 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9197 0.9758 1.3909 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1402 0.4883 2.6703 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1405 1.9773 1.1842 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 2.5958 2.3163 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2818 3.7419 2.8805 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5817 4.8510 1.9487 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6662 5.0073 0.7823 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3104 5.4606 1.2929 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4003 4.2757 1.7262 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7493 4.4627 1.8707 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0846 2.9729 2.0205 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8088 2.0902 2.0167 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2741 -2.3855 -2.7568 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0628 -0.6392 -2.2157 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6725 -1.2970 -2.5841 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5510 -3.0463 -0.6248 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9902 -2.0153 -0.4804 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4316 -1.5931 1.2829 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9006 -0.7306 1.3565 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4085 -2.5526 0.8144 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4329 -2.7380 2.3354 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1404 -4.1331 -0.3348 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0285 -4.3192 1.0752 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7248 -5.3201 2.4458 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4767 -6.2173 0.9621 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7037 -6.2850 1.4512 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8995 -4.5843 1.7476 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9576 -7.1434 -0.2919 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5934 -2.4639 -2.2915 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2827 -1.0834 -0.9103 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2686 -1.6333 1.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0371 -2.7831 1.6872 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3957 -0.6060 1.2874 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9610 0.1796 1.0664 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1495 -1.4361 3.5423 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8982 0.3086 3.3635 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0486 0.5786 1.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4266 -3.4311 -2.3028 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1433 -1.8460 -3.6129 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1807 3.2780 -3.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0481 4.4948 -4.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7700 3.2956 -5.9876 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6579 0.8120 -6.1601 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5187 -1.2075 -5.6455 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9356 0.3543 -3.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8004 0.9149 -0.9611 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0679 1.1712 -2.1635 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8083 -0.4936 -1.6343 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3674 0.7803 -0.6513 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3702 1.4791 0.5693 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7509 -0.1481 -0.0969 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2462 0.0988 1.6707 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4708 0.0981 3.2859 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4218 1.8301 3.1162 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2654 3.2993 3.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7699 4.0540 3.8202 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5110 5.8124 2.5401 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6414 4.8493 1.5645 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1184 5.7846 0.1107 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5328 4.1050 0.1758 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4692 6.1709 2.1375 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 5.9909 0.4626 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0669 5.1060 1.1828 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 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 12 14 1 0 14 15 2 0 14 16 1 0 16 17 2 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 23 1 0 21 22 2 0 7 24 1 0 24 25 2 0 25 26 1 0 25 27 1 0 27 28 1 0 28 29 2 0 29 37 1 0 37 38 1 0 38 39 1 0 29 30 1 0 30 31 2 0 31 32 1 0 32 33 2 0 33 34 1 0 34 35 2 0 35 36 1 0 3 40 1 0 40 41 1 0 40 42 1 0 42 43 1 0 42 44 2 0 44 45 1 0 45 46 1 0 46 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 50 51 1 0 50 52 1 0 52 53 2 0 38 27 1 0 35 30 1 0 52 45 1 0 1 54 1 0 1 55 1 0 1 56 1 0 2 57 1 0 2 58 1 0 3 59 1 1 7 60 1 1 8 61 1 0 8 62 1 0 9 63 1 0 9 64 1 0 10 65 1 0 10 66 1 0 11 67 1 0 11 68 1 0 13 69 1 0 16 70 1 0 17 71 1 0 18 72 1 0 18 73 1 0 19 74 1 0 19 75 1 0 20 76 1 0 20 77 1 0 23 78 1 0 26 79 1 0 27 80 1 6 38 86 1 6 39 87 1 0 39 88 1 0 39 89 1 0 31 81 1 0 32 82 1 0 33 83 1 0 34 84 1 0 36 85 1 0 40 90 1 6 41 91 1 0 41 92 1 0 41 93 1 0 43 94 1 0 45 95 1 1 46 96 1 0 46 97 1 0 47 98 1 0 47 99 1 0 48100 1 0 48101 1 0 49102 1 0 49103 1 0 51104 1 0 M END