0 mol 11 unq 0 iso 0 dist 9.23212 7.86896 4.61088 11.3059 6.54358 4.10106 12.8782 6.86684 5.96346 6.859 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 9.04834 6.05535 4.7319 5.37568 7.65889 6.86055 5.36911 6.51133 6.72833 5.94982 numMergedOcc 0
2 mol 16 unq 1 iso 0 dist 8.17898 5.72175 5.05803 5.37568 6.42835 5.01101 5.36911 5.30082 6.93532 5.94982 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 6.35095 5.76725 5.54419 5.06352 6.6219 4.82629 10.3893 6.56748 11.3566 9.73647 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 6.35095 5.76725 5.54419 7.63533 5.68215 10.1698 10.3893 6.56748 11.3566 7.26334 numMergedOcc 0
5 mol 24 unq 2 iso 0 dist 6.35095 5.76725 5.54419 7.63533 5.68215 10.1698 10.2645 4.50066 9.83002 6.19899 numMergedOcc 0
6 mol 24 unq 3 iso 0 dist 6.35095 5.76725 5.54419 7.63533 5.68215 10.1698 9.89331 5.11617 8.4051 6.61696 numMergedOcc 0
7 mol 24 unq 4 iso 0 dist 5.87895 5.75653 7.36323 6.87351 8.87744 6.28159 7.06532 6.38336 8.23446 4.5711 numMergedOcc 0
8 mol 24 unq 5 iso 0 dist 5.87895 5.75653 7.36323 7.79018 7.27472 5.50396 7.06532 6.38336 8.23446 4.44526 numMergedOcc 0
9 mol 24 unq 6 iso 0 dist 5.87895 5.75653 7.36323 7.79018 7.27472 5.50396 11.0714 6.7828 8.75662 9.586 numMergedOcc 0
10 mol 25 unq 0 iso 0 dist 8.23292 12.4427 5.04899 13.0315 6.55597 4.69295 11.6867 5.77929 8.87757 9.16515 numMergedOcc 0
11 mol 25 unq 1 iso 0 dist 8.23292 12.4427 5.04899 9.50063 7.07751 8.79309 11.6867 5.77929 8.87757 9.82987 numMergedOcc 0
12 mol 25 unq 2 iso 0 dist 8.23292 12.4427 5.04899 10.985 9.49421 13.6145 11.6867 5.77929 8.87757 6.53269 numMergedOcc 0
13 mol 25 unq 3 iso 0 dist 8.23292 12.4427 5.04899 10.985 9.49421 13.6145 11.9631 6.68639 9.61019 9.81524 numMergedOcc 0
14 mol 73 unq 0 iso 0 dist 6.30194 10.5627 6.19304 10.7557 8.68662 6.20232 10.9561 6.56633 9.24757 8.96616 numMergedOcc 0
15 mol 73 unq 1 iso 0 dist 6.30194 10.5627 6.19304 11.1632 7.4369 5.70116 10.9561 6.56633 9.24757 6.14542 numMergedOcc 0
16 mol 73 unq 2 iso 0 dist 5.79954 14.1415 9.38498 11.5216 9.73086 17.4121 6.66506 5.11416 13.8696 6.14542 numMergedOcc 0
17 mol 73 unq 3 iso 0 dist 5.79954 12.8388 9.96396 11.5216 9.73086 5.70116 6.66506 5.11416 9.24757 6.14542 numMergedOcc 0
18 mol 73 unq 4 iso 0 dist 5.79954 9.65653 9.75218 11.5216 9.73086 14.844 6.66506 5.11416 13.0145 6.14542 numMergedOcc 0
19 mol 73 unq 5 iso 0 dist 7.01889 7.9573 9.38498 16.3376 9.73086 17.4121 11.8962 5.11416 13.8696 6.14542 numMergedOcc 0
20 mol 73 unq 6 iso 0 dist 7.01889 15.0744 9.96396 16.3376 9.73086 5.70116 11.8962 5.11416 9.24757 6.14542 numMergedOcc 0
21 mol 73 unq 7 iso 0 dist 7.01889 8.11922 9.75218 16.3376 9.73086 14.844 11.8962 5.11416 13.0145 6.14542 numMergedOcc 0
22 mol 134 unq 0 iso 0 dist 5.67862 9.52819 6.37586 10.8891 7.93372 8.06642 10.8422 5.29786 6.23142 9.0176 numMergedOcc 0
23 mol 134 unq 1 iso 0 dist 5.67862 12.4156 9.71307 10.8891 7.93372 4.00092 10.8422 5.29786 9.94764 9.0176 numMergedOcc 0
24 mol 143 unq 0 iso 0 dist 5.30872 6.3915 5.99315 5.88056 5.37047 4.78563 9.99577 6.48978 7.78652 5.06564 numMergedOcc 0
25 mol 143 unq 1 iso 0 dist 5.30872 6.3915 5.99315 5.88056 5.37047 4.78563 10.2769 5.20762 8.91301 7.5373 numMergedOcc 0
26 mol 204 unq 0 iso 0 dist 7.7292 13.4646 7.10633 5.99091 7.9133 10.7169 8.82861 5.86489 11.5776 9.48625 numMergedOcc 0
27 mol 204 unq 1 iso 0 dist 7.7292 9.54287 8.51516 5.99091 7.9133 5.57347 8.82861 5.86489 7.32294 9.48625 numMergedOcc 0
28 mol 224 unq 0 iso 0 dist 7.25658 5.38198 6.65832 4.69994 6.99769 5.76843 11.8723 5.91654 10.8507 9.25617 numMergedOcc 0
29 mol 224 unq 1 iso 0 dist 7.25658 5.38198 6.65832 4.69994 6.99769 5.76843 11.9201 9.14278 13.4196 9.05276 numMergedOcc 0
30 mol 229 unq 0 iso 0 dist 8.0007 5.29674 9.87838 6.80826 6.95201 4.61227 14.548 10.2411 13.8021 9.37336 numMergedOcc 0
31 mol 232 unq 0 iso 0 dist 7.47238 10.134 8.27212 6.2559 6.71524 5.10213 9.78197 4.9377 9.40808 9.9183 numMergedOcc 0
32 mol 239 unq 0 iso 0 dist 9.27989 12.1502 6.16342 3.28983 6.73665 10.6736 6.91534 11.169 11.308 8.95511 numMergedOcc 0
33 mol 239 unq 1 iso 0 dist 9.27989 12.1502 6.16342 3.28983 6.73665 10.6736 9.05892 5.88931 10.3435 5.85002 numMergedOcc 0
