RDKit 3D 45 48 0 0 0 0 0 0 0 0999 V2000 5.3510 -0.0910 -0.2907 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3604 0.8123 0.1454 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0040 0.4564 0.1638 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5871 -0.7851 -0.2416 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2287 -1.0959 -0.2067 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2743 -0.2066 0.2196 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7216 1.0213 0.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0588 1.3537 0.5923 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4817 2.6366 1.0121 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1727 -0.5543 0.2510 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9259 -0.0231 -0.9029 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1770 1.4619 -0.8698 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.9922 1.8529 -1.9325 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3530 2.7283 -2.7896 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7424 1.9801 0.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5304 1.0164 1.4916 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8554 -0.1012 1.4854 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5563 -1.1718 2.5175 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9321 -2.3028 1.7382 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3254 -1.9938 0.3785 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5168 -2.7962 -0.4478 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8937 -2.4666 -0.6625 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0519 -0.6257 -1.2338 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2879 0.4347 -0.5474 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5733 -0.8758 0.4736 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3312 -1.5001 -0.5819 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0659 1.8091 0.9774 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4701 2.8150 0.9694 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9484 -0.5060 -0.8855 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4999 -0.3434 -1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2018 2.0041 -1.0433 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0853 2.9757 -3.5959 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1127 3.7017 -2.2937 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4188 2.2863 -3.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4395 3.0115 0.6553 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8636 2.0798 0.2414 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9980 1.2423 2.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4524 -1.5503 3.0008 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8917 -0.7789 3.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1832 -2.1895 1.8708 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1901 -3.2919 2.0739 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 -3.8926 -0.1648 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0122 -2.8096 -1.4694 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2376 -2.5790 -1.7203 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5835 -3.1490 -0.0809 H 0 0 0 0 0 0 0 0 0 0 0 0 14 13 1 0 13 12 1 0 12 15 1 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 8 3 1 0 3 2 1 0 2 1 1 0 3 4 2 0 6 10 1 0 10 11 1 6 11 12 1 0 10 17 1 0 10 20 1 0 4 5 1 0 14 32 1 0 14 33 1 0 14 34 1 0 12 31 1 6 15 35 1 0 15 36 1 0 16 37 1 0 18 38 1 0 18 39 1 0 19 40 1 0 19 41 1 0 21 42 1 0 21 43 1 0 22 44 1 0 22 45 1 0 7 27 1 0 9 28 1 0 1 23 1 0 1 24 1 0 1 25 1 0 4 26 1 0 11 29 1 0 11 30 1 0 M END