B6NP8K -OEChem-04012113143D 40 43 0 0 0 0 0 0 0999 V2000 -1.2187 -3.6935 -0.6234 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5010 0.3778 0.4409 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0355 -3.6316 -0.9075 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4650 -3.7260 -0.3255 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1684 1.3398 -1.6670 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9448 0.0003 1.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3697 -1.8452 0.3784 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4065 0.2787 0.9614 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1637 -1.2310 0.4911 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0365 -0.8268 0.3704 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0155 -1.7728 0.0807 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9546 0.8835 1.5656 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1109 1.4129 1.3811 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4347 -0.7900 0.1935 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5133 1.7961 0.5076 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0132 -3.0804 -0.5149 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1492 0.3394 0.6095 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4957 1.4222 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4052 -3.1110 -0.1936 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6194 1.3937 -0.2285 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9150 3.0282 0.2812 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1371 2.2394 -1.2096 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4326 3.8739 -0.6998 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5437 3.4795 -1.4452 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9092 0.9225 -0.7868 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4066 0.9205 -0.8753 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7454 0.2784 2.0242 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5158 1.4571 2.3903 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6248 2.2551 1.8585 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9552 -1.6291 -0.2603 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2184 -1.4037 0.7117 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0657 2.2900 1.5176 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1037 0.4394 -0.0506 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0627 3.3631 0.8617 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0043 1.9339 -1.7877 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9734 4.8415 -0.8804 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9478 4.1388 -2.2079 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7781 -0.1055 -0.8188 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7141 1.3519 -1.8321 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8247 1.5272 -0.0684 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 19 1 0 0 0 0 2 17 1 0 0 0 0 2 25 1 0 0 0 0 3 16 2 0 0 0 0 4 19 2 0 0 0 0 5 25 2 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 6 12 1 0 0 0 0 7 9 1 0 0 0 0 7 19 1 0 0 0 0 7 31 1 0 0 0 0 8 10 2 0 0 0 0 8 13 1 0 0 0 0 9 11 2 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 16 1 0 0 0 0 12 15 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 18 2 0 0 0 0 13 29 1 0 0 0 0 14 17 2 0 0 0 0 14 30 1 0 0 0 0 15 20 2 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 18 32 1 0 0 0 0 20 22 1 0 0 0 0 20 33 1 0 0 0 0 21 23 2 0 0 0 0 21 34 1 0 0 0 0 22 24 2 0 0 0 0 22 35 1 0 0 0 0 23 24 1 0 0 0 0 23 36 1 0 0 0 0 24 37 1 0 0 0 0 25 26 1 0 0 0 0 26 38 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 M END $$$$