D02OAS OpenBabel06211915323D 60 62 0 0 0 0 0 0 0 0999 V2000 0.9304 -0.0678 0.0235 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5309 1.1109 -0.3844 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2510 -0.0678 0.0235 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5309 -1.2465 0.4313 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0907 -1.2465 0.4313 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3706 -0.0678 0.0235 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2909 -2.4905 0.8618 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0517 -2.4905 0.8618 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6115 -2.4905 0.8618 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8914 -1.3118 0.4539 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4512 -1.3118 0.4539 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7311 -2.4905 0.8618 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4911 -3.7345 1.2922 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6912 -0.0678 0.0235 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6139 0.9522 -0.3295 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1406 2.2173 -0.7673 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8534 6.3212 -2.1874 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9483 5.3208 -1.8412 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5323 5.5695 -1.9272 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5964 4.5350 -1.5693 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0765 3.2518 -1.1252 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0256 6.9238 -2.3958 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1690 7.7969 -2.6980 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8612 10.0095 -3.4636 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6790 9.1066 -3.1512 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4216 4.0556 -1.4034 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8177 3.8104 -1.3185 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3712 11.3192 -3.9168 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3265 12.3751 -4.2822 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8209 12.1126 -4.1914 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9029 13.5075 -4.6740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0873 -0.2297 0.0795 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8914 2.0247 -0.7006 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2830 -0.0678 0.0235 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5747 -2.0911 0.7236 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8866 0.7768 -0.2688 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0837 -2.4905 0.8618 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0955 -3.3351 1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4074 -0.4672 0.1617 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5430 -3.5497 1.2283 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2326 -4.5504 0.6501 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2326 -3.9790 2.3013 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0760 0.2714 0.8306 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0760 -0.2999 -0.8207 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5818 4.7132 -1.6309 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0911 3.0736 -1.0636 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4312 7.3684 -1.6252 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4312 6.7970 -3.2764 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7357 7.3731 -3.4326 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4557 9.5649 -4.2342 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4557 10.1363 -2.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0846 8.9799 -4.0318 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0845 9.5512 -2.3806 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9840 2.8115 -0.9729 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2605 4.5031 -0.6337 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2605 3.9317 -2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4033 11.4892 -3.9756 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9872 11.1137 -3.8457 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2637 12.8054 -3.5066 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2637 12.2340 -5.1578 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 1 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 7 1 0 0 0 0 12 13 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 2 0 0 0 0 20 45 1 0 0 0 0 21 16 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 28 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 23 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 30 58 1 0 0 0 0 30 59 1 0 0 0 0 30 60 1 0 0 0 0 M END $$$$