BN1XG8
-OEChem-04012112572D
38 39 0 0 0 0 0 0 0999 V2000
4.5032 -2.6739 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
5.5032 -2.6739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5032 -2.6739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6942 1.9139 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.7431 1.6048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5032 1.3261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0032 2.8649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5032 0.3261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3122 1.9139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0032 2.8649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5352 0.6267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4154 3.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3692 -0.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6372 -0.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5032 -1.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3692 -1.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6372 -1.1739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5032 -3.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2039 1.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9019 1.7223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3676 3.3665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4149 2.7347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5392 2.6888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5851 1.8132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9288 0.7556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4063 0.0202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1417 0.4978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9170 4.0384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0510 4.1755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9138 3.3095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9062 0.1361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1003 0.1361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9062 -1.4839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1003 -1.4839 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8832 -3.6739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5032 -4.2939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1232 -3.6739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
1 3 2 0 0 0 0
1 16 1 0 0 0 0
1 19 1 0 0 0 0
4 5 1 0 0 0 0
4 6 1 0 0 0 0
4 7 1 0 0 0 0
5 11 1 0 0 0 0
5 12 1 0 0 0 0
5 20 1 0 0 0 0
6 8 1 0 0 0 0
6 9 2 0 0 0 0
7 10 2 0 0 0 0
7 13 1 0 0 0 0
8 14 2 0 0 0 0
8 15 1 0 0 0 0
9 10 1 0 0 0 0
9 21 1 0 0 0 0
10 22 1 0 0 0 0
11 23 1 0 0 0 0
11 24 1 0 0 0 0
11 25 1 0 0 0 0
12 26 1 0 0 0 0
12 27 1 0 0 0 0
12 28 1 0 0 0 0
13 29 1 0 0 0 0
13 30 1 0 0 0 0
13 31 1 0 0 0 0
14 17 1 0 0 0 0
14 32 1 0 0 0 0
15 18 2 0 0 0 0
15 33 1 0 0 0 0
16 17 2 0 0 0 0
16 18 1 0 0 0 0
17 34 1 0 0 0 0
18 35 1 0 0 0 0
19 36 1 0 0 0 0
19 37 1 0 0 0 0
19 38 1 0 0 0 0
M END
$$$$