0 mol 58 unq 0 iso 0 dist 9.78668 6.82593 8.55712 7.88172 10.7828 7.6481 12.965 19.3557 13.9007 8.80614 numMergedOcc 0
1 mol 92 unq 0 iso 0 dist 7.36335 6.12826 5.32369 7.44343 3.87825 6.72712 11.8037 9.68271 9.32974 6.95572 numMergedOcc 0
2 mol 92 unq 1 iso 0 dist 7.36335 5.02124 7.03417 7.2131 9.04084 7.1539 6.82886 10.5604 9.97281 5.37007 numMergedOcc 0
3 mol 92 unq 2 iso 0 dist 7.36335 5.02124 7.03417 7.44343 3.87825 5.39745 11.8037 9.68271 6.99832 6.95572 numMergedOcc 0
4 mol 130 unq 0 iso 0 dist 9.79115 14.8266 7.92317 11.8788 3.90693 6.90634 12.426 10.1588 6.01663 9.72053 numMergedOcc 0
5 mol 130 unq 1 iso 0 dist 9.79115 14.8266 7.92317 11.8788 3.90693 6.90634 16.9336 11.308 12.8559 7.7949 numMergedOcc 0
6 mol 141 unq 0 iso 0 dist 9.80185 10.3678 6.50336 11.8903 3.80087 4.25566 19.1124 10.8338 10.5489 8.10291 numMergedOcc 0
7 mol 141 unq 1 iso 0 dist 7.43587 8.51234 9.68074 9.80549 5.16197 8.00449 5.42993 9.3273 4.29204 9.87644 numMergedOcc 0
8 mol 156 unq 0 iso 0 dist 9.15935 9.73855 8.22067 10.0516 5.64188 6.05323 16.8708 13.7491 8.31653 9.00416 numMergedOcc 0
9 mol 156 unq 1 iso 0 dist 8.24388 10.9497 8.22067 11.8338 5.64188 6.05323 18.9384 13.7491 8.31653 9.00416 numMergedOcc 0
10 mol 181 unq 0 iso 0 dist 6.19329 4.97806 7.61421 10.0499 13.4378 7.13252 6.94401 11.8368 4.77278 6.2479 numMergedOcc 0
11 mol 181 unq 1 iso 0 dist 6.19329 4.97806 7.61421 10.0499 13.4378 7.13252 5.07895 9.70481 5.88819 6.22122 numMergedOcc 0
12 mol 181 unq 2 iso 0 dist 6.19329 4.97806 7.61421 10.0499 13.4378 7.13252 13.9623 15.9184 9.14057 7.99195 numMergedOcc 0
13 mol 234 unq 0 iso 0 dist 9.8226 6.14528 5.69634 10.5552 6.67757 7.43663 4.93539 9.7221 5.9221 7.32499 numMergedOcc 0
14 mol 234 unq 1 iso 0 dist 9.8226 15.0842 6.81195 10.5552 6.67757 7.94068 4.93539 9.7221 13.2297 7.32499 numMergedOcc 0
15 mol 234 unq 2 iso 0 dist 9.2653 5.43106 5.69634 12.8308 6.67757 7.43663 9.99124 9.7221 5.9221 7.32499 numMergedOcc 0
16 mol 234 unq 3 iso 0 dist 9.2653 12.788 6.81195 12.8308 6.67757 7.94068 9.99124 9.7221 13.2297 7.32499 numMergedOcc 0
17 mol 234 unq 4 iso 0 dist 8.33309 13.0843 5.69634 12.5509 6.67757 7.43663 17.671 9.7221 5.9221 7.32499 numMergedOcc 0
18 mol 234 unq 5 iso 0 dist 8.33309 6.7061 6.81195 12.5509 6.67757 7.94068 17.671 9.7221 13.2297 7.32499 numMergedOcc 0
19 mol 265 unq 0 iso 0 dist 6.80043 4.98228 5.94614 7.49913 6.31696 5.40318 5.56416 9.78483 4.65134 6.71375 numMergedOcc 0
20 mol 287 unq 0 iso 0 dist 9.78064 5.89971 7.77225 8.9316 3.96271 5.59555 5.64519 9.18744 4.62998 8.91712 numMergedOcc 0
21 mol 287 unq 1 iso 0 dist 9.78064 5.89971 7.77225 8.9316 3.96271 5.59555 12.3119 13.0643 7.23534 9.65934 numMergedOcc 0
22 mol 288 unq 0 iso 0 dist 9.78064 5.89971 7.77225 8.9316 3.96271 5.59555 5.64519 9.18744 4.62998 8.91712 numMergedOcc 0
23 mol 288 unq 1 iso 0 dist 9.78064 5.89971 7.77225 8.9316 3.96271 5.59555 12.3119 13.0643 7.23534 9.65934 numMergedOcc 0
24 mol 289 unq 0 iso 0 dist 9.78064 5.89971 7.77225 8.9316 3.96271 5.59555 5.64519 9.18744 4.62998 8.91712 numMergedOcc 0
25 mol 289 unq 1 iso 0 dist 9.78064 5.89971 7.77225 8.9316 3.96271 5.59555 12.3119 13.0643 7.23534 9.65934 numMergedOcc 0
26 mol 292 unq 0 iso 0 dist 7.89784 7.32101 3.93401 9.78409 4.30125 5.7131 9.91235 9.82511 5.98906 9.88863 numMergedOcc 0
27 mol 292 unq 1 iso 0 dist 7.83983 5.737 3.93401 9.46421 4.30125 5.7131 7.70348 9.82511 5.98906 9.88863 numMergedOcc 0
