D0Y6HD
-OEChem-10191521572D
47 48 0 1 0 0 0 0 0999 V2000
2.5369 0.2327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 1.7327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -0.7673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.4651 -0.7673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 0.7327 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.5991 0.7327 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -0.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 -1.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 0.2327 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
3.4030 -2.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5369 -0.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 0.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 0.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 0.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4651 0.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.3312 0.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5991 1.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.3312 1.7327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4651 2.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.2251 0.1980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.2251 2.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.1312 0.7119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.1312 1.7535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 0.7327 0.0000 B 0 0 0 0 0 0 0 0 0 0 0 0
4.4810 -1.3499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8796 -0.6597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 -0.6473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 0.8527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 1.3527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7830 -2.2673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 -2.8873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8469 -0.2304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.4573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2269 -1.3043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0230 -2.2673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2656 1.2076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4685 1.2076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3346 -0.2423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1316 -0.2423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 2.0427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4651 2.8527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.2179 -0.4220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.2179 2.8873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.5427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 2.0427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.6669 0.3998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.6669 2.0656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 24 1 0 0 0 0
1 44 1 0 0 0 0
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3 14 2 0 0 0 0
4 15 2 0 0 0 0
9 5 1 1 0 0 0
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6 13 1 0 0 0 0
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8 11 1 0 0 0 0
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9 24 1 0 0 0 0
9 28 1 0 0 0 0
10 30 1 0 0 0 0
10 31 1 0 0 0 0
10 35 1 0 0 0 0
11 32 1 0 0 0 0
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11 34 1 0 0 0 0
12 13 1 0 0 0 0
12 14 1 0 0 0 0
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12 37 1 0 0 0 0
13 38 1 0 0 0 0
13 39 1 0 0 0 0
15 16 1 0 0 0 0
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17 19 2 0 0 0 0
17 40 1 0 0 0 0
18 19 1 0 0 0 0
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20 22 1 0 0 0 0
20 42 1 0 0 0 0
21 23 1 0 0 0 0
21 43 1 0 0 0 0
22 23 2 0 0 0 0
22 46 1 0 0 0 0
23 47 1 0 0 0 0
M END
$$$$