0 mol 7 unq 0 iso 0 dist 8.88982 13.9585 7.10621 9.83056 6.09254 7.21217 14.1217 7.12508 6.1206 5.07985 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.88982 13.9585 7.10621 9.83056 6.09254 7.21217 16.6084 11.143 7.67927 6.83196 numMergedOcc 0
2 mol 38 unq 0 iso 0 dist 8.19077 6.12182 7.50293 9.81175 7.35595 9.23576 6.12374 4.40004 7.26639 4.57886 numMergedOcc 0
3 mol 117 unq 0 iso 0 dist 9.60425 5.17524 9.84395 5.38954 6.29427 7.70533 5.20001 6.57678 6.10127 6.66127 numMergedOcc 0
4 mol 127 unq 0 iso 0 dist 8.09965 11.3174 9.30299 9.78409 9.75166 8.40046 17.0406 12.8087 6.08673 12.1959 numMergedOcc 0
5 mol 129 unq 0 iso 0 dist 7.00798 5.57978 8.54584 10.7832 11.5533 6.29026 8.62413 12.1739 5.51197 4.79473 numMergedOcc 0
6 mol 129 unq 1 iso 0 dist 7.00798 5.57978 8.54584 10.7832 11.5533 6.29026 6.93102 5.63254 8.86944 10.1802 numMergedOcc 0
7 mol 129 unq 2 iso 0 dist 7.00798 5.57978 8.54584 10.7832 11.5533 6.29026 8.4375 8.26896 6.69691 5.04019 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 8.29673 9.35671 8.22656 15.9373 15.4455 9.4473 13.5739 6.9945 7.22643 12.9426 numMergedOcc 0
9 mol 152 unq 0 iso 0 dist 9.0847 14.8573 8.56324 21.5487 13.2491 8.89982 12.8022 5.39112 6.59889 9.0696 numMergedOcc 0
10 mol 152 unq 1 iso 0 dist 9.0847 14.8573 8.56324 21.5487 13.2491 8.89982 13.3531 4.84714 8.9192 9.83062 numMergedOcc 0
11 mol 178 unq 0 iso 0 dist 5.41229 4.51874 6.69288 9.32502 12.2822 8.0974 10.6504 8.44333 9.11204 9.80877 numMergedOcc 0
12 mol 178 unq 1 iso 0 dist 8.57378 4.51874 6.43573 9.32502 12.4338 8.0974 10.6504 6.8202 9.11204 9.80877 numMergedOcc 0
13 mol 224 unq 0 iso 0 dist 8.47457 8.1404 6.60589 15.6817 9.36962 9.79616 11.4433 5.76843 8.79428 12.65 numMergedOcc 0
14 mol 224 unq 1 iso 0 dist 8.47457 15.1783 9.16166 15.3716 7.18448 9.29703 11.4433 5.76843 6.8692 9.56183 numMergedOcc 0
15 mol 238 unq 0 iso 0 dist 5.99187 5.87189 7.31233 9.67278 12.1448 5.24313 13.2221 10.3162 9.12776 12.4194 numMergedOcc 0
16 mol 259 unq 0 iso 0 dist 6.20344 10.3156 7.46176 18.0859 14.8465 7.93997 13.5375 10.067 5.85442 7.06301 numMergedOcc 0
17 mol 259 unq 1 iso 0 dist 6.20344 10.3156 7.46176 18.0859 14.8465 7.93997 13.6039 11.6988 6.95511 7.80863 numMergedOcc 0
