0 mol 34 unq 0 iso 0 dist 9.18109 7.36836 15.1968 5.66535 6.87871 9.99939 numMergedOcc 0
1 mol 67 unq 0 iso 0 dist 6.23298 8.4702 11.6017 11.8103 9.9348 19.9807 numMergedOcc 0
2 mol 101 unq 0 iso 0 dist 5.5199 6.67863 4.19577 4.50603 8.77773 10.7342 numMergedOcc 0
3 mol 109 unq 0 iso 0 dist 9.79844 6.3323 5.26527 11.8455 6.31633 10.2046 numMergedOcc 0
4 mol 109 unq 1 iso 0 dist 9.79844 6.3323 5.26527 15.9176 7.21115 12.4369 numMergedOcc 0
5 mol 117 unq 0 iso 0 dist 6.81489 6.01857 5.11935 10.0087 7.70533 10.1696 numMergedOcc 0
6 mol 120 unq 0 iso 0 dist 9.12964 9.18784 7.47617 5.91353 8.91606 12.8123 numMergedOcc 0
7 mol 129 unq 0 iso 0 dist 8.63018 7.84813 6.14663 5.56946 6.29026 7.97548 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 6.85651 4.82356 3.75786 4.84607 8.84018 5.78814 numMergedOcc 0
9 mol 133 unq 1 iso 0 dist 9.21256 8.22722 11.2135 13.46 6.11955 13.0458 numMergedOcc 0
10 mol 133 unq 2 iso 0 dist 6.23615 8.52036 11.2135 4.64588 6.11955 13.0458 numMergedOcc 0
11 mol 133 unq 3 iso 0 dist 7.03858 8.83476 3.75786 11.981 8.84018 5.78814 numMergedOcc 0
12 mol 147 unq 0 iso 0 dist 6.00651 8.76449 6.99467 10.4619 9.84695 16.3808 numMergedOcc 0
13 mol 147 unq 1 iso 0 dist 6.00651 8.76449 6.99467 6.91778 9.18866 6.73617 numMergedOcc 0
14 mol 147 unq 2 iso 0 dist 6.00651 8.36182 4.53687 10.4619 9.84695 14.3777 numMergedOcc 0
15 mol 147 unq 3 iso 0 dist 6.00651 8.36182 4.53687 6.91778 9.18866 9.03544 numMergedOcc 0
16 mol 162 unq 0 iso 0 dist 9.51731 9.067 3.57652 6.46702 9.82249 7.93088 numMergedOcc 0
17 mol 180 unq 0 iso 0 dist 5.43774 7.58661 6.15473 6.54937 8.44989 9.63576 numMergedOcc 0
18 mol 180 unq 1 iso 0 dist 5.43774 6.53993 4.52794 6.54937 8.44989 11.5859 numMergedOcc 0
19 mol 180 unq 2 iso 0 dist 8.31061 5.81023 6.15473 6.91082 8.44989 9.63576 numMergedOcc 0
20 mol 180 unq 3 iso 0 dist 8.31061 8.4285 4.52794 6.91082 8.44989 11.5859 numMergedOcc 0
21 mol 183 unq 0 iso 0 dist 9.92635 7.16035 10.7786 10.0008 7.31181 9.96536 numMergedOcc 0
22 mol 183 unq 1 iso 0 dist 9.92635 6.2675 14.145 10.0008 7.31181 13.9709 numMergedOcc 0
23 mol 183 unq 2 iso 0 dist 7.85507 9.61725 10.7786 9.95614 7.31181 9.96536 numMergedOcc 0
24 mol 183 unq 3 iso 0 dist 7.85507 9.52042 14.145 9.95614 7.31181 13.9709 numMergedOcc 0
25 mol 213 unq 0 iso 0 dist 5.01229 7.49754 5.36904 4.67262 4.58599 4.66576 numMergedOcc 0
26 mol 232 unq 0 iso 0 dist 6.11539 8.54126 3.79439 5.70808 8.68464 8.60731 numMergedOcc 0
27 mol 232 unq 1 iso 0 dist 9.71082 9.33969 13.4178 4.86949 8.68464 13.8204 numMergedOcc 0
28 mol 232 unq 2 iso 0 dist 9.71082 7.64079 3.79439 4.86949 8.68464 8.60731 numMergedOcc 0
29 mol 255 unq 0 iso 0 dist 8.22083 7.80616 6.60718 12.7687 6.57549 13.1759 numMergedOcc 0
30 mol 274 unq 0 iso 0 dist 8.26851 9.82713 13.8247 4.56913 6.00877 13.2967 numMergedOcc 0
31 mol 274 unq 1 iso 0 dist 8.14634 9.82713 9.90818 4.56913 8.66451 13.2967 numMergedOcc 0
32 mol 283 unq 0 iso 0 dist 7.90132 9.35302 7.27864 4.44211 9.53225 9.07995 numMergedOcc 0
33 mol 283 unq 1 iso 0 dist 7.90132 8.85163 13.4741 4.44211 9.53225 12.3883 numMergedOcc 0
34 mol 294 unq 0 iso 0 dist 5.27236 7.48987 4.99494 5.57606 6.47832 7.56669 numMergedOcc 0
35 mol 294 unq 1 iso 0 dist 5.27236 8.35637 9.15036 5.57606 6.47832 13.4324 numMergedOcc 0
