0 mol 11 unq 0 iso 0 dist 9.07476 5.8961 6.84216 9.46202 6.83186 11.0597 9.52695 6.76736 5.96346 10.0282 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 9.04534 5.71129 6.58046 9.26728 6.83186 10.7048 9.84802 8.84131 4.30695 14.2498 numMergedOcc 0
2 mol 11 unq 2 iso 0 dist 9.04534 5.71129 6.58046 9.26728 6.83186 10.7048 9.78754 6.51674 6.35398 9.81983 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 8.6586 13.2653 8.23075 10.3497 8.25818 13.5399 13.5984 12.2271 8.70827 19.1942 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 8.6586 13.2653 8.23075 10.3497 8.25818 13.5399 18.4559 12.2839 6.73939 14.8722 numMergedOcc 0
5 mol 85 unq 0 iso 0 dist 9.86038 5.8457 8.04242 7.41484 4.18248 8.37717 12.8003 13.5973 7.54568 15.3758 numMergedOcc 0
6 mol 113 unq 0 iso 0 dist 7.08403 14.0364 7.02367 3.77247 7.02358 13.0914 9.09263 5.40648 8.8822 9.34113 numMergedOcc 0
7 mol 113 unq 1 iso 0 dist 7.08403 14.0364 7.02367 3.77247 7.02358 13.0914 5.37302 3.52111 9.66219 5.35711 numMergedOcc 0
8 mol 117 unq 0 iso 0 dist 9.30187 6.7814 7.78789 9.55157 9.02015 4.46691 12.6334 6.05048 7.70232 6.5788 numMergedOcc 0
9 mol 117 unq 1 iso 0 dist 9.30187 6.7814 7.78789 9.55157 9.02015 4.46691 10.3116 4.42665 7.4671 6.2771 numMergedOcc 0
10 mol 122 unq 0 iso 0 dist 6.80798 4.42285 4.42563 4.61966 8.565 6.34716 11.7617 11.3935 9.23819 14.9314 numMergedOcc 0
11 mol 122 unq 1 iso 0 dist 6.80798 4.42285 4.42563 4.61966 8.565 6.34716 11.999 8.90201 8.88537 15.1966 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 9.48934 6.4437 9.3273 10.5537 5.60448 6.80544 6.78469 5.16197 9.87644 9.62774 numMergedOcc 0
13 mol 141 unq 1 iso 0 dist 6.41183 5.91683 9.3273 5.51254 5.60448 6.80544 8.01453 5.16197 9.87644 9.62774 numMergedOcc 0
14 mol 213 unq 0 iso 0 dist 7.49754 7.78293 8.82761 7.61073 9.71831 4.67313 14.0634 15.5804 7.37798 10.7796 numMergedOcc 0
15 mol 213 unq 1 iso 0 dist 7.49754 7.78293 8.82761 7.61073 9.71831 4.67313 11.6475 6.78109 7.73322 8.59946 numMergedOcc 0
16 mol 213 unq 2 iso 0 dist 7.49754 4.67262 4.66576 7.61073 9.71831 7.49785 11.6475 6.78109 8.14332 8.59946 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 7.84189 7.19628 5.30118 9.51119 4.68668 3.65199 7.76945 5.39801 9.65934 9.25759 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 7.84189 7.19628 5.30118 9.51119 4.68668 3.65199 7.76945 5.39801 9.65934 9.25759 numMergedOcc 0
19 mol 289 unq 0 iso 0 dist 7.84189 7.19628 5.30118 9.51119 4.68668 3.65199 7.76945 5.39801 9.65934 9.25759 numMergedOcc 0
