RDKit 3D 68 69 0 0 0 0 0 0 0 0999 V2000 -0.9690 -1.8147 1.9775 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1494 -1.2922 0.5729 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0473 -1.5384 -0.2816 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7357 -0.5051 -0.7498 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4019 0.6528 -0.3667 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8993 -0.6240 -1.6307 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0901 0.0896 -1.2007 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3130 0.6636 0.0476 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 0.5041 0.8929 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4602 1.4068 0.5179 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4237 1.8469 1.8593 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4483 2.5357 2.4075 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5640 2.8310 1.6676 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6848 2.4471 0.3689 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7949 2.7179 -0.4544 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9387 3.4071 -0.0849 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1265 3.8818 1.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5871 1.7141 -0.1998 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7207 1.3518 -1.4534 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0934 -1.9547 -2.2034 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6702 -2.9708 -1.2532 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8171 -2.4444 -2.5851 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4840 -1.6838 -0.0160 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.4312 -1.1415 0.9499 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2545 -0.0934 0.5917 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1108 0.3446 -0.6031 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2595 0.5343 1.4801 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9109 1.6931 0.8563 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8663 1.4940 -0.1118 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5288 2.5063 -0.7428 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2516 3.8083 -0.4179 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2827 4.0398 0.5657 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6158 3.0096 1.2004 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6325 -3.1618 -0.0609 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.9730 -3.5632 -0.6711 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5528 -3.8189 -0.7904 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7981 -4.1895 -1.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2779 -4.0854 -0.3083 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9183 -1.5356 2.5184 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1701 -1.2171 2.4534 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8751 -2.8897 2.0705 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2085 -0.1694 0.6991 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5395 0.0591 -2.5229 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8636 0.1696 -1.9328 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5622 1.6314 2.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4367 2.8853 3.4519 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3674 3.3892 2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7712 2.3621 -1.4643 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7794 3.5841 -0.7901 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8110 1.1032 -2.3115 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6541 -1.8910 -3.1586 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2409 -3.9669 -1.4804 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4139 -2.6669 -0.2185 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7691 -3.0843 -1.3875 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4169 -1.9051 -3.2901 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6248 -1.2441 -1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0255 -0.2287 1.7025 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8242 0.8313 2.4646 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1019 0.4691 -0.3851 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2771 2.3095 -1.5076 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7219 4.6713 -0.8619 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0128 5.0555 0.8716 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8707 3.1753 1.9602 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6209 -3.5933 0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8033 -2.9991 -0.2222 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1279 -4.6343 -0.3415 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9363 -3.5717 -1.7559 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2383 -4.6971 0.5097 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 8 9 2 0 8 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 2 0 14 18 2 0 18 19 1 0 6 20 1 0 20 21 1 0 20 22 1 0 2 23 1 0 23 24 1 0 24 25 1 0 25 26 2 0 25 27 1 0 27 28 1 0 28 29 2 0 29 30 1 0 30 31 2 0 31 32 1 0 32 33 2 0 23 34 1 0 34 35 1 0 34 36 1 0 36 37 2 0 36 38 1 0 18 10 1 0 33 28 1 0 1 39 1 0 1 40 1 0 1 41 1 0 2 42 1 1 6 43 1 6 7 44 1 0 11 45 1 0 12 46 1 0 13 47 1 0 15 48 1 0 16 49 1 0 19 50 1 0 20 51 1 6 21 52 1 0 21 53 1 0 21 54 1 0 22 55 1 0 23 56 1 6 27 57 1 0 27 58 1 0 29 59 1 0 30 60 1 0 31 61 1 0 32 62 1 0 33 63 1 0 34 64 1 1 35 65 1 0 35 66 1 0 35 67 1 0 38 68 1 0 M END