ATOM 40
1 C1x C 5.6000 -7.3500
2 C1x C 5.6000 -8.7500
3 C1x C 6.8124 -9.4500
4 C2y C 8.0249 -8.7500
5 C2y C 8.0249 -7.3500
6 C1z C 6.8124 -6.6500
7 C2b C 9.2624 -6.6500
8 C2b C 10.4749 -7.3500
9 C2c C 11.6873 -6.6500
10 C2b C 12.8997 -7.3500
11 C1a C 9.2560 -9.4610
12 C1a C 7.5124 -5.4376
13 C1a C 6.1124 -5.4376
14 C1a C 11.6873 -5.2500
15 C2b C 12.8851 -8.7500
16 C2b C 14.1000 -9.4456
17 C2c C 14.0351 -10.8456
18 C2b C 15.3201 -11.5412
19 C2b C 15.3251 -12.9412
20 C2b C 16.5401 -13.6368
21 C2b C 16.5452 -15.0368
22 C2c C 17.7601 -15.7324
23 C2b C 17.7652 -17.1324
24 C2b C 18.9802 -17.8280
25 C1a C 12.9197 -11.5362
26 C1a C 18.9769 -15.0238
27 C2b C 18.9728 -19.2500
28 C2c C 20.1866 -19.9476
29 C2b C 20.1894 -21.3476
30 C1a C 21.3766 -19.2572
31 C2b C 21.3819 -22.0333
32 C2y C 21.3848 -23.4496
33 C2y C 20.1479 -24.1676
34 C1x C 20.1511 -25.5676
35 C1x C 21.3652 -26.2647
36 C1x C 22.6022 -25.5467
37 C1z C 22.5989 -24.1468
38 C1a C 18.9355 -23.4713
39 C1a C 23.2989 -22.9343
40 C1a C 23.9989 -24.1468
BOND 41
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 1
7 5 7 1
8 7 8 2
9 8 9 1
10 9 10 2
11 4 11 1
12 6 12 1
13 6 13 1
14 9 14 1
15 10 15 1
16 15 16 2
17 16 17 1
18 17 18 2
19 18 19 1
20 19 20 2
21 20 21 1
22 21 22 2
23 22 23 1
24 23 24 2
25 17 25 1
26 22 26 1
27 24 27 1
28 27 28 2
29 28 29 1
30 28 30 1
31 29 31 2
32 31 32 1
33 32 33 2
34 33 34 1
35 34 35 1
36 35 36 1
37 36 37 1
38 32 37 1
39 33 38 1
40 37 39 1
41 37 40 1
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