B4C5JA -OEChem-04012116402D 36 41 0 1 0 0 0 0 0999 V2000 3.2352 0.1214 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8446 0.1028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0916 2.1562 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9124 3.5407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5938 -1.7013 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5938 -3.3108 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1156 -1.9852 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0332 -0.4714 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0216 -1.4714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9156 -2.0060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5509 1.0641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5508 1.0525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9156 -3.0060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0610 1.9358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7816 -1.5060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5709 2.7960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6476 -2.0060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6476 -3.0060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7816 -3.5060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0608 1.9127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5709 2.7844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0216 -3.5407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.1461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1156 -3.0268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1774 -2.5060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2716 -0.8489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7816 -0.8860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7816 -4.1260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6808 1.9055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8870 3.3178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0288 -4.1607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8151 3.7379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3921 3.0244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5798 -3.3389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6383 -2.9208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6383 -2.0913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 11 1 0 0 0 0 2 8 1 0 0 0 0 2 12 1 0 0 0 0 3 14 1 0 0 0 0 3 23 1 0 0 0 0 4 16 1 0 0 0 0 4 23 1 0 0 0 0 5 17 1 0 0 0 0 5 25 1 0 0 0 0 6 18 1 0 0 0 0 6 25 1 0 0 0 0 7 9 2 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 1 0 0 0 9 10 1 0 0 0 0 10 13 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 20 1 0 0 0 0 13 19 2 0 0 0 0 13 22 1 0 0 0 0 14 16 2 0 0 0 0 15 17 1 0 0 0 0 15 27 1 0 0 0 0 16 21 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 28 1 0 0 0 0 20 21 2 0 0 0 0 20 29 1 0 0 0 0 21 30 1 0 0 0 0 22 24 2 0 0 0 0 22 31 1 0 0 0 0 23 32 1 0 0 0 0 23 33 1 0 0 0 0 24 34 1 0 0 0 0 25 35 1 0 0 0 0 25 36 1 0 0 0 0 M END $$$$