B1Q0VA -OEChem-04022104103D 64 69 0 0 0 0 0 0 0999 V2000 -4.9780 1.5539 -1.9269 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7246 3.1541 -1.6190 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 -2.2378 -0.7418 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9025 2.5258 -0.2600 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1593 -3.2502 2.5693 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9592 3.0775 2.7976 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8731 -3.8900 0.3588 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8709 1.1983 1.7906 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1818 -0.5684 -0.7443 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3409 2.9005 0.2320 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2447 -0.2274 2.2522 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3119 1.2591 -2.5832 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8541 -4.4715 -1.8846 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0876 0.1153 0.6553 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0657 -4.9589 0.6138 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9515 1.0112 2.7319 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5160 -4.4824 0.5923 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2187 1.7597 2.3256 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3814 -2.0741 0.9502 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8890 2.2717 0.8731 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1418 -0.1458 0.1016 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1232 2.3796 -0.9915 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2846 -0.6499 1.4063 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0942 1.7800 -1.3596 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3785 -1.6248 1.8064 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 1.7407 -0.3943 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4335 -3.0929 1.3652 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9310 2.2326 1.8837 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0475 0.8294 -0.2984 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1222 2.4185 -1.9568 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3261 -1.5166 -0.3084 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3395 2.8376 1.1346 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9108 -3.8580 -0.7235 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7401 1.3427 0.9724 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0445 1.2790 0.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9184 1.8872 -3.2239 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0999 0.7214 1.8165 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6898 1.3216 -3.4855 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6679 -2.3499 -2.4424 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4888 1.3088 -1.3168 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2882 -3.6053 -2.8689 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5163 0.0978 -0.6576 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1015 -5.7198 -0.1567 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1609 -5.4104 1.5857 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1416 -0.0665 2.7877 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6256 1.3460 3.7226 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1761 -5.3388 0.7755 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6774 -3.7787 1.4185 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0241 2.8392 2.3497 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0021 1.5650 3.0681 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1592 -3.7629 -0.6062 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7832 0.4975 1.0622 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4619 -2.0406 2.8093 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0508 1.3075 -0.6745 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5678 -1.7779 -1.0386 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5796 3.2702 2.1006 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7626 2.0388 0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6739 1.9136 -4.0019 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8545 1.0291 2.5323 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4664 0.8918 -4.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0352 -1.5200 -3.0289 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7744 1.5290 -2.3354 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 -3.9427 -3.8964 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8426 -0.8370 -1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 2 30 1 0 0 0 0 3 33 1 0 0 0 0 3 39 1 0 0 0 0 4 34 1 0 0 0 0 4 40 1 0 0 0 0 5 27 2 0 0 0 0 6 28 2 0 0 0 0 7 15 1 0 0 0 0 7 27 1 0 0 0 0 7 51 1 0 0 0 0 8 16 1 0 0 0 0 8 28 1 0 0 0 0 8 52 1 0 0 0 0 9 21 1 0 0 0 0 9 31 2 0 0 0 0 10 22 1 0 0 0 0 10 32 2 0 0 0 0 11 23 2 0 0 0 0 11 37 1 0 0 0 0 12 24 2 0 0 0 0 12 38 1 0 0 0 0 13 33 2 0 0 0 0 13 41 1 0 0 0 0 14 34 2 0 0 0 0 14 42 1 0 0 0 0 15 17 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 18 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 33 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 34 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 25 2 0 0 0 0 19 27 1 0 0 0 0 19 31 1 0 0 0 0 20 26 2 0 0 0 0 20 28 1 0 0 0 0 20 32 1 0 0 0 0 21 23 1 0 0 0 0 21 29 2 0 0 0 0 22 24 1 0 0 0 0 22 30 2 0 0 0 0 23 25 1 0 0 0 0 24 26 1 0 0 0 0 25 53 1 0 0 0 0 26 54 1 0 0 0 0 29 35 1 0 0 0 0 30 36 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 35 37 2 0 0 0 0 35 57 1 0 0 0 0 36 38 2 0 0 0 0 36 58 1 0 0 0 0 37 59 1 0 0 0 0 38 60 1 0 0 0 0 39 41 2 0 0 0 0 39 61 1 0 0 0 0 40 42 2 0 0 0 0 40 62 1 0 0 0 0 41 63 1 0 0 0 0 42 64 1 0 0 0 0 M END $$$$