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Text File | 1996-10-24 | 1.8 KB | 49 lines | [TEXT/Lnus] |
- - = 0.18 (0.499992,0.499992,0.499992)
- H = 0.9, 0.36 (1,1,1) ;H
- C = 1.5, 0.6 (0.5,0.5,0.5) ;C
- H16:0.058 1.144 2.043 ;type=UNK name= num=0 chain= ss= ssid= elem=H aloc=H
- H15:1.596 1.16 1.065 ;type=UNK name= num=0 chain= ss= ssid= elem=H aloc=H
- H14:-0.44 2.043 -0.424 ;type=UNK name= num=0 chain= ss= ssid= elem=H aloc=H
- H9:-2.084 -0.104 -0.79 ;type=UNK name= num=0 chain= ss= ssid= elem=H aloc=H
- H8:-2.245 0.803 0.761 ;type=UNK name= num=0 chain= ss= ssid= elem=H aloc=H
- H11:1.421 0.842 -1.563 ;type=UNK name= num=0 chain= ss= ssid= elem=H aloc=H
- H10:-0.038 -0.08 -2.09 ;type=UNK name= num=0 chain= ss= ssid= elem=H aloc=H
- H13:2.203 -0.998 -0.361 ;type=UNK name= num=0 chain= ss= ssid= elem=H aloc=H
- H12:0.765 -1.973 -0.849 ;type=UNK name= num=0 chain= ss= ssid= elem=H aloc=H
- H19:1.006 -1.341 1.795 ;type=UNK name= num=0 chain= ss= ssid= elem=H aloc=H
- H18:-1.278 -1.995 0.455 ;type=UNK name= num=0 chain= ss= ssid= elem=H aloc=H
- H17:-1.459 -1.031 1.969 ;type=UNK name= num=0 chain= ss= ssid= elem=H aloc=H
- C7:0.56 0.758 1.127 ;type=UNK name= num=0 chain= ss= ssid= elem=C aloc=C
- C6:-0.259 0.978 -0.157 ;type=UNK name= num=0 chain= ss= ssid= elem=C aloc=C
- C5:-1.55 0.189 0.141 ;type=UNK name= num=0 chain= ss= ssid= elem=C aloc=C
- C4:0.572 0.212 -1.206 ;type=UNK name= num=0 chain= ss= ssid= elem=C aloc=C
- C3:1.089 -1.002 -0.41 ;type=UNK name= num=0 chain= ss= ssid= elem=C aloc=C
- C2:0.489 -0.772 0.991 ;type=UNK name= num=0 chain= ss= ssid= elem=C aloc=C
- C1:-1.031 -1.023 0.939 ;type=UNK name= num=0 chain= ss= ssid= elem=C aloc=C
- C7-H16
- C7-H15
- C6-C7
- C6-H14
- C5-H8
- C5-C6
- C5-H9
- C4-C6
- C4-H10
- C4-H11
- C3-H13
- C3-C4
- C3-H12
- C2-H19
- C2-C7
- C2-C3
- C1-H17
- C1-C2
- C1-C5
- C1-H18
- ;;start instance definitions here;;
- ;instancetext:example3\
- \
- This file contains\
- 19 atoms\
- 20 bonds
-