ATOM 61
1 C2y C 27.1620 -17.3989
2 C1y C 25.9212 -16.7349
3 C1x C 28.4377 -16.9214
4 N2x N 26.9347 -18.7737
5 C1z C 24.9076 -17.7194
6 C1b C 25.9388 -15.3368
7 C8y C 29.6842 -17.4456
8 C2y C 25.5484 -18.9892
9 C1b C 23.5038 -17.7135
10 C1a C 24.3834 -16.4263
11 C1b C 24.7329 -14.6321
12 C8y C 30.8900 -16.7291
13 N4x N 29.9814 -18.8146
14 C2x C 24.8786 -20.2766
15 C6a C 22.8165 -16.4962
16 C6a C 24.7503 -13.2283
17 C8y C 31.9386 -17.6611
18 C1b C 30.8843 -15.3137
19 C8y C 31.3735 -18.9426
20 C8y C 25.5484 -21.5581
21 O6a O 21.4184 -16.4845
22 O6a O 23.5212 -15.2845
23 O6a O 23.5505 -12.5176
24 O6a O 25.9678 -12.5409
25 C1b C 33.3366 -17.6554
26 C6a C 32.0958 -14.6147
27 C1x C 31.8978 -20.2417
28 C8y C 24.9076 -22.8163
29 N4x N 26.9290 -21.7620
30 C1b C 34.0240 -16.4379
31 O6a O 32.0958 -13.2166
32 O6a O 33.3133 -15.3078
33 C8y C 31.3385 -21.5348
34 C8y C 25.9154 -23.7832
35 C1b C 23.5329 -23.0435
36 C8y C 27.1562 -23.1484
37 C6a C 35.4277 -16.4263
38 C8y C 31.9445 -22.8105
39 N4x N 29.9521 -21.7270
40 C1b C 25.9038 -25.1872
41 C6a C 23.0437 -24.3483
42 C1x C 28.4377 -23.6260
43 O6a O 36.1210 -15.2088
44 O6a O 36.1384 -17.6378
45 C8y C 30.9250 -23.7601
46 C1b C 33.2957 -22.4377
47 C8y C 29.6959 -23.1018
48 C1b C 24.6747 -25.8919
49 O6a O 21.6689 -24.5814
50 O6a O 23.9290 -25.4260
51 C1b C 31.0589 -25.1522
52 C6a C 34.2861 -23.4163
53 C6a C 24.6689 -27.3016
54 C1b C 32.3404 -25.7347
55 O6a O 35.6376 -23.0494
56 O6a O 33.9366 -24.7736
57 O6a O 23.4631 -27.9890
58 O6a O 25.8746 -28.0007
59 C6a C 32.4686 -27.1327
60 O6a O 31.3211 -27.9366
61 O6a O 33.7560 -27.7094
BOND 65
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 2 6 1 #Down
6 3 7 1
7 4 8 1
8 5 9 1 #Up
9 5 10 1 #Down
10 6 11 1
11 7 12 2
12 7 13 1
13 8 14 2
14 9 15 1
15 11 16 1
16 12 17 1
17 12 18 1
18 13 19 1
19 14 20 1
20 15 21 1
21 15 22 2
22 16 23 1
23 16 24 2
24 17 25 1
25 18 26 1
26 19 27 1
27 20 28 2
28 20 29 1
29 25 30 1
30 26 31 1
31 26 32 2
32 27 33 1
33 28 34 1
34 28 35 1
35 29 36 1
36 30 37 1
37 33 38 2
38 33 39 1
39 34 40 1
40 35 41 1
41 36 42 1
42 37 43 1
43 37 44 2
44 38 45 1
45 38 46 1
46 39 47 1
47 40 48 1
48 41 49 1
49 41 50 2
50 45 51 1
51 46 52 1
52 48 53 1
53 51 54 1
54 52 55 1
55 52 56 2
56 53 57 1
57 53 58 2
58 54 59 1
59 59 60 1
60 59 61 2
61 5 8 1
62 17 19 2
63 34 36 2
64 42 47 1
65 45 47 2
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