RDKit 3D 101104 0 0 0 0 0 0 0 0999 V2000 5.5036 -3.9722 -1.5673 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4000 -2.9774 -1.6958 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8308 -1.7301 -2.4055 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6601 -2.7375 -0.4022 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4781 -2.2477 0.7327 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7066 -2.0431 1.9404 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4164 -2.5449 2.2192 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2433 -3.2411 3.2907 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2042 -2.3551 1.3942 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0581 -2.3929 2.2960 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1397 -3.0901 2.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8198 -3.6490 2.8962 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6590 -3.1957 0.5918 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2141 -4.5786 0.1497 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4788 -5.3778 0.4672 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4866 -4.4281 -0.1311 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0998 -3.1549 0.5190 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9217 -2.0905 0.9832 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8841 -2.4592 1.7501 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7555 -0.6598 0.6594 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.0210 -0.3706 -0.7996 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4033 -0.7361 -1.1882 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7874 -1.9515 -1.6984 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0943 -2.2369 -2.0398 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0833 -1.2876 -1.8763 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7190 -0.0628 -1.3665 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4010 0.2010 -1.0307 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5632 -0.0510 1.1798 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7818 0.9832 0.6584 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5457 0.7256 0.4546 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1822 2.3542 0.3019 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.5855 2.6748 0.8514 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3299 3.4070 0.8080 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0788 3.4040 1.3754 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 3.7452 2.6178 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2567 3.0673 0.8068 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0022 4.4134 0.7349 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2979 5.3807 -0.1321 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5494 5.4520 -1.4868 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9186 6.3439 -2.3083 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0052 7.2065 -1.7632 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2769 7.1560 -0.4047 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3785 6.2396 0.4089 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9575 2.1333 1.6620 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2524 1.6334 1.5203 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0448 1.7517 2.5272 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8474 0.9668 0.3334 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3059 2.0058 -0.7041 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2587 2.8528 -0.1355 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0632 0.2618 0.6760 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3642 -1.0931 0.4454 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5092 -1.3843 -0.0587 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3459 -4.8084 -2.2716 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5076 -3.5451 -1.8451 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5727 -4.4037 -0.5448 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6087 -3.4526 -2.3853 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3013 -1.6057 -3.4037 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5239 -0.8250 -1.8442 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9080 -1.7453 -2.6744 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7942 -2.0902 -0.6493 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2567 -3.7472 -0.0971 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1511 -3.1384 1.0093 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1817 -1.4567 2.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 -1.3437 0.8985 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0739 -3.1429 0.6088 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 -1.8767 3.1919 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1665 -2.4578 -0.0818 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9671 -4.6539 -0.9066 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4169 -5.0121 0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4784 -6.3490 -0.0665 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6574 -5.4482 1.5411 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3444 -4.3374 -1.2155 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4828 -4.7582 0.1855 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5912 -0.1073 1.2002 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3629 -1.1073 -1.3576 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6994 0.6051 -1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0414 -2.7131 -1.8412 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3767 -3.2168 -2.4467 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1216 -1.5108 -2.1466 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5065 0.6759 -1.2422 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1538 1.1920 -0.6274 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2517 -0.4767 2.1134 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2441 2.5071 -0.7944 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3454 2.5770 0.0812 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6402 3.7282 1.2262 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7185 2.0456 1.7526 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7969 4.3752 0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2051 2.7320 -0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0618 4.7661 1.7909 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0198 4.3271 0.3626 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2786 4.7730 -1.9257 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1259 6.3841 -3.3496 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 7.9226 -2.4028 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0111 7.8544 -0.0236 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 6.2322 1.4564 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 1.7839 2.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1349 0.3142 -0.2071 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4493 2.5388 -1.1597 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8281 1.4980 -1.5395 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6671 3.3821 -0.8636 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8062 0.8551 1.1571 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 21 22 1 0 22 23 2 0 23 24 1 0 24 25 2 0 25 26 1 0 26 27 2 0 20 28 1 0 28 29 1 0 29 30 2 0 29 31 1 0 31 32 1 0 31 33 1 0 33 34 1 0 34 35 2 0 34 36 1 0 36 37 1 0 37 38 1 0 38 39 2 0 39 40 1 0 40 41 2 0 41 42 1 0 42 43 2 0 36 44 1 0 44 45 1 0 45 46 2 0 45 47 1 0 47 48 1 0 48 49 1 0 47 50 1 0 50 51 1 0 51 52 2 0 51 5 1 0 17 13 1 0 27 22 1 0 43 38 1 0 1 53 1 0 1 54 1 0 1 55 1 0 2 56 1 0 3 57 1 0 3 58 1 0 3 59 1 0 4 60 1 0 4 61 1 0 5 62 1 1 6 63 1 0 9 64 1 0 9 65 1 0 10 66 1 0 13 67 1 6 14 68 1 0 14 69 1 0 15 70 1 0 15 71 1 0 16 72 1 0 16 73 1 0 20 74 1 1 21 75 1 0 21 76 1 0 23 77 1 0 24 78 1 0 25 79 1 0 26 80 1 0 27 81 1 0 28 82 1 0 31 83 1 6 32 84 1 0 32 85 1 0 32 86 1 0 33 87 1 0 36 88 1 6 37 89 1 0 37 90 1 0 39 91 1 0 40 92 1 0 41 93 1 0 42 94 1 0 43 95 1 0 44 96 1 0 47 97 1 6 48 98 1 0 48 99 1 0 49100 1 0 50101 1 0 M END