L2W7DB
-OEChem-05032300173D
46 49 0 0 0 0 0 0 0999 V2000
-5.9055 1.2796 -1.3565 F 0 0 0 0 0 0 0 0 0 0 0 0
-5.4686 2.6221 0.3047 F 0 0 0 0 0 0 0 0 0 0 0 0
-6.3765 0.6770 0.6852 F 0 0 0 0 0 0 0 0 0 0 0 0
3.1210 0.5560 1.0231 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0000 1.3812 -1.4850 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3035 -1.7762 1.7703 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5230 -0.2607 0.1332 N 0 0 0 0 0 0 0 0 0 0 0 0
-3.1178 1.2903 -0.6827 N 0 0 0 0 0 0 0 0 0 0 0 0
4.9681 -2.3688 0.4313 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.1691 -0.7711 0.1747 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1312 -2.0987 -0.1705 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4739 -2.5424 -0.1116 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8397 0.1068 0.5723 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1601 -0.3294 0.6303 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4765 -1.6451 0.2908 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8715 -2.9960 -0.5729 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7743 -3.8701 -0.4569 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8037 0.8453 -0.7168 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4940 -0.8803 0.9483 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1164 0.7169 0.0548 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5549 -4.3117 -0.9124 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7654 -4.7479 -0.8544 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8678 -0.3354 0.8373 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2859 1.7006 0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1138 2.9633 0.8308 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.4758 1.3287 -0.0787 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8553 -2.0455 0.3686 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6280 1.5814 -1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2838 4.1071 0.0506 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7474 3.1099 2.2708 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7979 2.7251 -1.8632 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6258 3.9879 -1.2964 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5875 1.1255 0.8572 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9112 -2.7058 -0.6854 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7896 -4.2579 -0.4283 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3378 -4.9930 -1.2326 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0110 -5.7717 -1.1215 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3650 2.0809 -1.2715 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6392 -0.8099 1.4334 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7761 0.6070 -1.5403 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1520 5.0981 0.4767 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4188 2.5180 2.9018 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8256 4.1498 2.6060 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7167 2.7812 2.4365 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0663 2.6325 -2.9115 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7583 4.8783 -1.9041 H 0 0 0 0 0 0 0 0 0 0 0 0
1 26 1 0 0 0 0
2 26 1 0 0 0 0
3 26 1 0 0 0 0
4 14 1 0 0 0 0
4 24 1 0 0 0 0
5 18 2 0 0 0 0
6 19 2 0 0 0 0
7 10 1 0 0 0 0
7 18 1 0 0 0 0
7 19 1 0 0 0 0
8 18 1 0 0 0 0
8 20 1 0 0 0 0
8 38 1 0 0 0 0
9 27 3 0 0 0 0
10 11 1 0 0 0 0
10 13 2 0 0 0 0
11 12 1 0 0 0 0
11 16 2 0 0 0 0
12 15 1 0 0 0 0
12 17 2 0 0 0 0
13 14 1 0 0 0 0
13 33 1 0 0 0 0
14 15 2 0 0 0 0
15 27 1 0 0 0 0
16 21 1 0 0 0 0
16 34 1 0 0 0 0
17 22 1 0 0 0 0
17 35 1 0 0 0 0
19 23 1 0 0 0 0
20 23 2 0 0 0 0
20 26 1 0 0 0 0
21 22 2 0 0 0 0
21 36 1 0 0 0 0
22 37 1 0 0 0 0
23 39 1 0 0 0 0
24 25 1 0 0 0 0
24 28 2 0 0 0 0
25 29 2 0 0 0 0
25 30 1 0 0 0 0
28 31 1 0 0 0 0
28 40 1 0 0 0 0
29 32 1 0 0 0 0
29 41 1 0 0 0 0
30 42 1 0 0 0 0
30 43 1 0 0 0 0
30 44 1 0 0 0 0
31 32 2 0 0 0 0
31 45 1 0 0 0 0
32 46 1 0 0 0 0
M END
$$$$