Merge pull request #16 from ZontaNicola/main

add new template

Author: greglandrum

templates.smi

@@ -73,3 +73,4 @@ C1C2CC3CC1CC3C2 |(-7.01,3.13,;-7.71,4.35,;-7.01,5.56,;-5.61,5.56,;-4.91,4.35,;-5
 C1CC2C3CCC4C1C1CCC2C2CCC1C1CCC2C3CCC41 |(-1.94049,-5.53747,;-1.94049,-1.8102,;-0.825758,-0.511159,;-1.57576,0.787879,;-3.07576,0.787879,;-3.07576,-2.93939,;-1.57576,-2.93939,;-0.825758,-4.23843,;0.674242,-4.23843,;1.72266,-5.53747,;1.72266,-1.8102,;0.674242,-0.511159,;1.42424,0.787879,;2.92424,0.787879,;2.92424,-2.93939,;1.42424,-2.93939,;0.674242,-1.64036,;1.72266,-0.341318,;1.72266,3.38596,;0.674242,2.08692,;-0.825758,2.08692,;-1.94049,3.38596,;-1.94049,-0.341318,;-0.825758,-1.64036,)|
 C1CC2CC1C2 |(0.562,0.77,;0.562,-0.77,;-0.9027,-1.2459,;-1.8079,0,;-0.9027,1.2459,;-0.5912,0,)|
 C1C2C3CC4C5CC3C1C5C24 |(-1.68833,-1.6056,;-0.474804,-0.723925,;-1.13662,-0.251107,;0.360708,1.45266,;-0.93833,2.20266,;-2.43833,2.20266,;-3.73737,1.45266,;-2.19718,-0.251107,;-2.90185,-0.723925,;-2.43833,0.70266,;-0.93833,0.70266,)|
+[#6]12-[#6]-[#6]-[#6](-[#6]-[#6]-1)-[#6]-[#6]1-[#6]-[#6]-[#6](-[#6]-[#6]-1)-[#6]1-[#6]-[#6]-[#6](-[#6]-[#6]3-[#6]-[#6]-[#6](-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-2)-[#6]-[#6]-3)-[#6]-[#6]-1 |(-4.50109,2.65143,;-3.19401,1.91553,;-3.17777,0.415622,;-4.46861,-0.348398,;-5.77569,0.387492,;-5.79193,1.88741,;-4.45237,-1.84831,;-3.15333,-2.59831,;-1.85429,-1.84831,;-0.555251,-2.59831,;-0.55525,-4.09831,;-1.85428,-4.84831,;-3.15333,-4.09831,;6.07594,-4.09867,;7.37497,-4.84866,;8.67401,-4.09866,;8.67402,-2.59866,;9.97305,-1.84866,;9.97305,-0.348662,;11.2721,0.401339,;11.2721,1.90134,;9.97305,2.65134,;9.97305,4.15134,;8.47305,4.15134,;7.17402,4.90134,;5.87498,4.15134,;4.57594,4.90134,;3.2769,4.15134,;1.97786,4.90134,;0.678826,4.15134,;-0.620212,4.90134,;-1.91925,4.15134,;-3.21829,4.90134,;-4.51733,4.15134,;8.67402,1.90134,;8.67402,0.401336,;7.37498,-1.84867,;6.07593,-2.59867,)|