B8WD3T
-OEChem-04012116382D
48 51 0 0 0 0 0 0 0999 V2000
4.5981 -4.5000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 4.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 2.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 2.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -1.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -3.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -3.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9282 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7942 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3894 3.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7880 2.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7880 4.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3894 3.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3426 3.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9441 4.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -0.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -0.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 -1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 -0.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6592 -3.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -0.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4651 -1.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 -4.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4842 -4.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.3312 -3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.1042 -2.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 29 1 0 0 0 0
2 11 1 0 0 0 0
2 14 1 0 0 0 0
3 13 2 0 0 0 0
4 10 1 0 0 0 0
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5 20 1 0 0 0 0
5 40 1 0 0 0 0
6 21 1 0 0 0 0
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10 11 1 0 0 0 0
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11 32 1 0 0 0 0
11 33 1 0 0 0 0
12 15 2 0 0 0 0
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13 14 1 0 0 0 0
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14 35 1 0 0 0 0
15 18 1 0 0 0 0
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16 19 2 0 0 0 0
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17 18 2 0 0 0 0
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21 23 2 0 0 0 0
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22 27 1 0 0 0 0
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23 26 1 0 0 0 0
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24 42 1 0 0 0 0
26 44 1 0 0 0 0
27 45 1 0 0 0 0
28 46 1 0 0 0 0
28 47 1 0 0 0 0
28 48 1 0 0 0 0
M END
$$$$