BO3NJ1
-OEChem-04012113373D
37 38 0 1 0 0 0 0 0999 V2000
-4.3227 1.7306 -0.3878 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7726 0.6530 1.7618 O 0 0 0 0 0 0 0 0 0 0 0 0
4.1092 0.6185 -0.6752 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1544 -0.0582 0.0595 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.5140 -3.2227 1.2158 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.0149 1.1155 -0.8135 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5477 -0.5253 0.0565 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2482 -1.1261 -0.3581 C 0 0 1 0 0 0 0 0 0 0 0 0
-2.9781 2.2111 -0.3655 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4754 0.6089 0.4829 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1919 -0.6562 -0.4397 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8208 -0.2149 0.7093 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8382 -0.6815 -1.6611 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3965 -2.2980 0.5242 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1451 0.2168 0.6341 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1624 -0.2495 -1.7364 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8160 0.1996 -0.5887 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6720 2.0436 2.0628 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1236 -0.3652 -0.4808 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2337 0.8456 -1.8552 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0098 1.5472 -0.7761 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7090 -1.3508 0.7575 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8347 -0.8678 -0.9467 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5482 -1.4614 -1.3628 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7363 2.5769 0.6399 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9190 3.0629 -1.0507 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.5181 0.2811 0.4219 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2856 0.9201 1.5175 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3051 -0.1967 1.6656 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3411 -1.0275 -2.5623 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6785 -0.2647 -2.6926 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6259 2.3280 2.2152 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1118 2.6443 1.2604 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2249 2.2351 2.9864 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0971 0.1240 -0.5729 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0508 -1.1469 -1.2436 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0466 -0.8062 0.5181 H 0 0 0 0 0 0 0 0 0 0 0 0
1 9 1 0 0 0 0
1 10 1 0 0 0 0
2 15 1 0 0 0 0
2 18 1 0 0 0 0
3 17 1 0 0 0 0
3 19 1 0 0 0 0
4 6 1 0 0 0 0
4 7 1 0 0 0 0
4 8 1 0 0 0 0
5 14 3 0 0 0 0
6 9 1 0 0 0 0
6 20 1 0 0 0 0
6 21 1 0 0 0 0
7 10 1 0 0 0 0
7 22 1 0 0 0 0
7 23 1 0 0 0 0
8 11 1 0 0 0 0
8 14 1 0 0 0 0
8 24 1 0 0 0 0
9 25 1 0 0 0 0
9 26 1 0 0 0 0
10 27 1 0 0 0 0
10 28 1 0 0 0 0
11 12 2 0 0 0 0
11 13 1 0 0 0 0
12 15 1 0 0 0 0
12 29 1 0 0 0 0
13 16 2 0 0 0 0
13 30 1 0 0 0 0
15 17 2 0 0 0 0
16 17 1 0 0 0 0
16 31 1 0 0 0 0
18 32 1 0 0 0 0
18 33 1 0 0 0 0
18 34 1 0 0 0 0
19 35 1 0 0 0 0
19 36 1 0 0 0 0
19 37 1 0 0 0 0
M END
$$$$