0 mol 37 unq 0 iso 0 dist 7.77333 7.86029 7.05769 12.3846 15.5011 9.25986 4.61408 11.0132 7.65802 9.16636 numMergedOcc 0
1 mol 64 unq 0 iso 0 dist 9.72287 6.27017 8.58468 7.95967 15.2632 9.86958 5.04832 10.8193 8.85416 5.88036 numMergedOcc 0
2 mol 91 unq 0 iso 0 dist 7.62621 8.01351 6.16048 7.97927 10.8851 5.78962 4.4056 9.63646 8.91354 7.47242 numMergedOcc 0
3 mol 103 unq 0 iso 0 dist 9.42444 8.10965 9.03322 4.76694 11.871 7.81042 12.706 15.3425 8.078 8.96379 numMergedOcc 0
4 mol 103 unq 1 iso 0 dist 9.42444 8.10965 9.03322 4.76694 11.871 7.81042 3.9634 11.0546 6.56481 5.73608 numMergedOcc 0
5 mol 103 unq 2 iso 0 dist 9.64736 8.10965 5.86578 4.76694 11.9113 7.81042 12.706 13.9005 8.078 8.96379 numMergedOcc 0
6 mol 103 unq 3 iso 0 dist 9.64736 8.10965 5.86578 4.76694 11.9113 7.81042 3.9634 8.23356 6.56481 5.73608 numMergedOcc 0
7 mol 132 unq 0 iso 0 dist 8.94096 5.52837 7.71763 9.98904 14.8819 8.15549 4.8602 11.5671 9.39389 10.8474 numMergedOcc 0
8 mol 132 unq 1 iso 0 dist 7.64207 5.52837 7.53392 9.98904 12.8674 8.15549 4.8602 8.72039 9.39389 10.8474 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 9.86691 8.72732 14.0828 10.5918 16.9398 5.12189 8.09812 6.9268 9.2759 10.8516 numMergedOcc 0
10 mol 133 unq 1 iso 0 dist 9.86691 8.72732 14.0828 5.48547 6.85651 7.50126 8.09812 6.9268 9.2759 5.35551 numMergedOcc 0
11 mol 167 unq 0 iso 0 dist 9.38623 7.04009 5.44954 6.20034 12.7444 9.82329 4.91302 6.28957 7.20545 9.97915 numMergedOcc 0
12 mol 217 unq 0 iso 0 dist 9.51059 8.29482 4.10975 4.89824 8.79299 6.01666 5.1774 7.80898 7.60302 5.16489 numMergedOcc 0
13 mol 266 unq 0 iso 0 dist 9.8678 9.4961 17.1354 10.3186 15.056 8.12204 5.53565 11.387 9.39714 5.91091 numMergedOcc 0
14 mol 266 unq 1 iso 0 dist 8.00278 9.4961 14.487 10.3186 10.8326 8.12204 5.53565 7.3055 9.39714 5.91091 numMergedOcc 0
15 mol 266 unq 2 iso 0 dist 9.10275 7.07099 10.5702 14.7313 12.9065 9.63694 4.19938 11.387 6.57444 13.1376 numMergedOcc 0
16 mol 266 unq 3 iso 0 dist 9.10275 7.07099 10.5702 14.7313 12.9065 9.63694 8.95939 16.4844 7.9555 14.6225 numMergedOcc 0
17 mol 266 unq 4 iso 0 dist 9.10275 7.07099 10.5702 7.14057 15.056 6.58277 4.19938 11.387 6.57444 5.91091 numMergedOcc 0
18 mol 266 unq 5 iso 0 dist 9.10275 7.07099 10.5702 7.14057 15.056 6.58277 8.95939 16.4844 7.9555 3.93133 numMergedOcc 0
19 mol 266 unq 6 iso 0 dist 9.10275 8.3978 17.1354 7.14057 15.056 8.12204 4.19938 11.387 9.39714 5.91091 numMergedOcc 0
20 mol 266 unq 7 iso 0 dist 6.13722 7.07099 6.1113 14.7313 10.0039 9.63694 4.19938 7.3055 6.57444 13.1376 numMergedOcc 0
21 mol 266 unq 8 iso 0 dist 6.13722 7.07099 6.1113 14.7313 10.0039 9.63694 8.95939 11.9279 7.9555 14.6225 numMergedOcc 0
22 mol 266 unq 9 iso 0 dist 6.13722 7.07099 6.1113 7.14057 10.8326 6.58277 4.19938 7.3055 6.57444 5.91091 numMergedOcc 0
23 mol 266 unq 10 iso 0 dist 6.13722 7.07099 6.1113 7.14057 10.8326 6.58277 8.95939 11.9279 7.9555 3.93133 numMergedOcc 0
24 mol 266 unq 11 iso 0 dist 6.13722 8.3978 14.487 7.14057 10.8326 8.12204 4.19938 7.3055 9.39714 5.91091 numMergedOcc 0
25 mol 287 unq 0 iso 0 dist 7.75212 9.04355 9.33717 14.8194 16.2259 8.0935 5.05806 10.656 6.96774 10.4601 numMergedOcc 0
26 mol 287 unq 1 iso 0 dist 7.75212 9.04355 9.33717 14.8194 16.2259 8.0935 11.1974 15.3165 7.14859 8.13485 numMergedOcc 0
27 mol 287 unq 2 iso 0 dist 7.90634 9.04355 5.66584 14.8194 12.4464 8.0935 5.05806 7.3388 6.96774 10.4601 numMergedOcc 0
28 mol 287 unq 3 iso 0 dist 7.90634 9.04355 5.66584 14.8194 12.4464 8.0935 11.1974 6.96248 7.14859 8.13485 numMergedOcc 0
29 mol 288 unq 0 iso 0 dist 7.75212 9.04355 9.33717 14.8194 16.2259 8.0935 5.05806 10.656 6.96774 10.4601 numMergedOcc 0
30 mol 288 unq 1 iso 0 dist 7.75212 9.04355 9.33717 14.8194 16.2259 8.0935 11.1974 15.3165 7.14859 8.13485 numMergedOcc 0
31 mol 288 unq 2 iso 0 dist 7.90634 9.04355 5.66584 14.8194 12.4464 8.0935 5.05806 7.3388 6.96774 10.4601 numMergedOcc 0
32 mol 288 unq 3 iso 0 dist 7.90634 9.04355 5.66584 14.8194 12.4464 8.0935 11.1974 6.96248 7.14859 8.13485 numMergedOcc 0
33 mol 289 unq 0 iso 0 dist 7.75212 9.04355 9.33717 14.8194 16.2259 8.0935 5.05806 10.656 6.96774 10.4601 numMergedOcc 0
34 mol 289 unq 1 iso 0 dist 7.75212 9.04355 9.33717 14.8194 16.2259 8.0935 11.1974 15.3165 7.14859 8.13485 numMergedOcc 0
35 mol 289 unq 2 iso 0 dist 7.90634 9.04355 5.66584 14.8194 12.4464 8.0935 5.05806 7.3388 6.96774 10.4601 numMergedOcc 0
36 mol 289 unq 3 iso 0 dist 7.90634 9.04355 5.66584 14.8194 12.4464 8.0935 11.1974 6.96248 7.14859 8.13485 numMergedOcc 0
